(+)-aplysinillin
(+)-dexrazoxane  +
(+)-dihydromyricetin  
(+)-lyoniresinol  +
(+)-syringaresinol  +
(-)-annonaine  +
(-)-beta-elemene
(-)-demecolcine  
(-)-epigallocatechin 3-gallate  
(-)-marinopyrrole A
(1-methyl-1H-imidazol-2-yl)(3-methyl-4-\{3-[(pyridin-3-ylmethyl)amino]propoxy\}-1-benzofuran-2-yl)methanone
(2->6)-beta-D-fructan
(2-nitrophenoxy)acetic acid
(22E,24R)-5alpha,8alpha-epidioxyergosta-6,9,22-triene-3beta-ol-3-O-beta-D-glucopyranoside
(2S),(2''S)-8,8''-5',5''-tetrahydroxy-7,7''-3,3''-4,4''-hexamethoxy-5,5''-biflavan
(2S),(2''S)-8,8''-5'-trihydroxy-7,7''-3,3''-4,4''-5''-heptamethoxy-5,5''-biflavan
(2S)-(-)-kurarinone  +
(2S)-2'-hydroxy-7,8,3',4',5'-pentamethoxyflavan
(2S)-2'-methoxykurarinone
(2S)-2-(\{(5Z)-5-[(5-ethylfuran-2-yl)methylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl\}amino)-2-(4-fluorophenyl)-N-[(4-nitrophenyl)sulfonyl]acetamide
(2S)-5,7-dimethoxy-8-(2S-hydroxy-3-methyl-3-butenyl)-3',4'-methylenedioxyflavanone
(2S)-5,7-dimethoxy-8-formylflavanone
(2S)-5-Hydroxy-7-methoxy-8-[(E)-3-oxo-1-butenyl]flavanone
(2Z,3Z)-bis\{amino[(2-aminophenyl)sulfanyl]methylidene\}butanedinitrile
(3-bromo-4-hydroxy-5-nitrophenyl)acetic acid  +
(3-bromo-4-hydroxy-5-nitrophenyl)acetyl azide
(3beta,16alpha)-16-hydroxy-13,28-epoxyoleanan-3-yl alpha-L-Rhap-(1->2)-beta-D-Glcp-(1->4)-[beta-D-Glcp-(1->2)]-alpha-L-arabinopyranoside
(3S,8aR)-3-(1H-imidazol-5-ylmethyl)hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
(4-hydroxy-3-iodo-5-nitrophenyl)acetic acid  +
(4-hydroxy-3-nitrophenyl)acetyl azide
(5Z)-3-benzyl-5-[(2-hydroxy-3-nitrophenyl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
(6S)-5-formyltetrahydrofolic acid
(S)-2-(4-nitrobenzyl)-DOTA
(S)-3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid
1,3-bis-([3-(4-\{3-[3-nitro-5-(galactopyranosyloxy)benzoylamino]propyl\}piperazin-1-yl)propylamino]carbonyloxy)-2-aminopropane
1,3-bis-([3-[3-[3-(4-\{3-[3-nitro-5-(galactopyranosyloxy)benzoylamino]propyl\}piperazin-1-yl)propylamino-3,4-dioxocyclobutenyl]aminopropoxyethoxyethoxy]propyl]aminocarbonyloxy)-2-aminopropane
1,3-bis-([[3-(4-\{3-[3-nitro-5-(galactopyranosyloxy)benzoylamino]propyl\}piperazin-1-yl)propylamino-3,4-dioxocyclobutenyl]aminoethyl]aminocarbonyloxy)-2-aminopropane
1-(2-deoxy-5-O-phosphono-beta-D-erythro-pentofuranosyl)-3-nitro-1H-pyrrole
1-(2-deoxy-5-O-phosphono-beta-D-ribosyl)-5-nitro-1H-indole-3-carboxamide
1-(3,4-dihydroxy-5-nitrophenyl)-3-\{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl\}propan-1-one
1-(4'-hydroxy-3'-methoxyphenyl)-7-phenyl-3-heptanone
1-(4-azido-2-nitrophenyl)amino-3-(1-oxyl-2,2,5,5-pyrrolidin-3-ylcarbonylamino)propan-2-yl diphosphate
1-(4-methoxybenzyl)-3-(5-nitro-1,3-thiazol-2-yl)urea
1-[(1R)-1-phenylethyl]-1H-imidazole-5-carboxylic acid  +  
1-acetyl-4-(4-\{4-[(2-ethoxyphenyl)thio]-3-nitrophenyl\}pyridin-2-yl)piperazine
1-benzyl-2-chloromethylimidazole  +
1-chloro-2,4,6-trinitrobenzene  
1-chloro-2,4-dinitrobenzene  
1-deoxysphinganine
1-fluoro-2,4-dinitrobenzene  
1-glycosylimidazole  +  
1-iodo-3-nitrobenzene
1-methyl-1H-imidazole
1-methyl-7-nitroisatoic anhydride
1-methyltryptophan
1-O-(alpha-D-galactopyranosyl)-N-hexacosanoylphytosphingosine  
10-hydroxycanthin-6-one
12-deacetoxy-21-acetoxyscalarin
12-O-acetyl-16-O-deacetyl-16-epi-scalarobutenolide
13,14-dihydro-Delta(12)-prostaglandin J2
14-norpseurotin A
15-O-deacetylnimbolidin B
16,23-epoxy-5beta-cholestane triglycoside
16-O-deacetyl-16-epi-scalarolbutenolide
18-oxotryprostatin A
1H-imidazole  +  
1R,4S,6R-1,4-endoperoxy-bisabola-2,10-diene
1S,4R,6R-1,4-endoperoxy-bisabola-2,10-diene
2',4'-dihydroxy-3'-(2-hydroxy benzyl)-6'-methoxy chalcone
2'-O-[2-(1H-imidazol-1-yl)ethyl]-5-methyluridine 5'-(dihydrogen phosphate)
2,2'-dinitrobiphenyl
2,3,6-trinitrophenol
2,4,5-trinitrobenzenesulfonic acid
2,4,6-trinitrobenzenesulfonic acid  
2,4-dinitro-1-naphthol
2,4-dinitro-1-thiocyanatobenzene
2,4-dinitrobenzenesulfonate  +
2,4-dinitrobenzenesulfonic acid  
2,4-dinitrophenetole
2,4-dinitrophenylhydrazine
2-(2,4-dihydroxy-5-prenylphenyl)-5,6-methylenedioxybenzofuran
2-amino-4-fluoro-5-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-N-1,3-thiazol-2-ylbenzamide
2-amino-5-[(1-methoxy-2-methylindolizin-3-yl)carbonyl]benzoic acid
2-amino-5-nitrobenzenesulfonic acid
2-aminopurine  
2-chloroimidazole
2-fluoroadenine  +
2-methoxy-17beta-estradiol  +  
2-methoxy-4-nitrophenyl isocyanate
2-methoxyidazoxan  
2-methylthio-N(6)-isopentenyladenine
2-nitro-1-(2-trifluoromethoxyphenyl)ethanone
2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine
2-nitro-p-toluidine
2-nitrobenzaldehyde  
2-nitrofuran
2-nitroimidazole
2-nitropropane  
20(R),22(xi),24(S)-dammar-25(26)-ene-3beta,6alpha,12beta,20,22,24-hexanol
20-epi-bryonolic acid
23,24-dimethylcholest-16(17)-E-en-3beta,5alpha,6beta,20(S)-tetrol
25-O-methoxycimigenol 3-O-alpha-L-arabinopyranoside
3',4',5-trihydroxy-3,6,7-trimethoxyflavone
3',4',7-trihydroxyisoflavone  
3'-deamino-3'-(3-cyanomorpholin-4-yl)doxorubicin  
3,3'-diindolylmethane  
3,5-di-O-caffeoyl quinic acid  +
3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one
3,5-dinitro-4-hydroxyphenylpyruvic acid
3,5-dinitrosalicylic acid
3-(4-nitrobenzenesulfonyloxy)methyl-5,5-dimethylbutyrolactone
3-(5-nitro-2-furyl)acrylamide
3-(\{(5R)-3-[3-(1H-imidazol-1-yl)propyl]-5-methyl-5-naphthalen-1-yl-2,4-dioxoimidazolidin-1-yl\}methyl)benzonitrile
3-(alpha-D-galactopyranosyloxy)-N-(2-morpholin-4-ylethyl)-5-nitrobenzamide
3-(alpha-D-galactopyranosyloxy)-N-(2-morpholin-4-ylpropyl)-5-nitrobenzamide
3-(galactopyranosyloxy)-N-(3-\{4-[3-(\{2-[(3-\{4-[3-(\{[3-(galactopyranosyloxy)-5-nitrophenyl]carbonyl\}amino)propyl]piperazin-1-yl\}propyl)amino]-3,4-dioxocyclobut-1-en-1-yl\}amino)propyl]piperazin-1-yl\}propyl)-5-nitrobenzamide
3-(imidazol-4-yl)-2-oxopropyl dihydrogen phosphate
3-(imidazol-4-yl)pyruvic acid
3-\{[(5-nitrofuran-2-yl)methylidene]amino\}-1,3-oxazol-2-one
3-acetamino-6-isobutyl-2,5-dioxopiperazine
3-beta-O-(E)-coumaroyl-D:C-friedooleana-7,9(11)-dien-29-oic acid
3-epi-heliangin
3-hydroxy-3-methylglutaric acid  +
3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
3-nitro-L-tyrosine
3-nitro-N-[(2Z)-4-[3-(1H-1,2,4-triazol-1-ylmethyl)phenyl]pyrimidin-2(5H)-ylidene]aniline
3-nitrocinnamic acid  +
3-nitropropan-1-ol
3-nitropropanoate
3-nitropropanoic acid  +  
3-nitrotyramine
3-O-ethylentacapone
3-O-methylentacapone
3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one
3beta-O-\{alpha-L-Rhap-(1->2)-beta-D-Glcp-(1->4)-[beta-D-Glcp-(1->2)]-alpha-L-Arap\}primulagenin A
4',5'-dihydro-11,5'-dihydroxy-4'-methoxytephrosin
4',5,7-trihydroxy-3'-methoxyflavone  +  
4'-epidoxorubicin  
4,4'-(ethyl-2-nitropropane-1,3-diyl)bismorpholine
4-(2-amino-4-methyl-1,3-thiazol-5-yl)-N-(3-nitrophenyl)pyrimidin-2-amine
4-(4-benzyl-4-methoxypiperidin-1-yl)-N-[(4-\{[1,1-dimethyl-2-(phenylsulfanyl)ethyl]amino\}-3-nitrophenyl)sulfonyl]benzamide
4-(4-nitrophenylazo)resorcinol
4-(\{5-[(2-aminoethyl)amino]-2,4-dinitrophenyl\}amino)-TEMPO
4-[1-(cyclopropylmethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyrimidin-2-amine
4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid
4-[4-(biphenyl-2-ylmethyl)piperazin-1-yl]-N-[4-\{[1,1-dimethyl-2-(phenylthio)ethyl]amino\}-3-nitrobenzenesulfonyl]benzamide
4-\{[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino\}benzoic acid  
4-hydroperoxycyclophosphamide  
4-hydroxy-3-nitrophenylacetaldehyde
4-hydroxyphenyl retinamide  
4-methoxymagnaldehyde B
4-methyl-5-pentylbenzene-1,3-diol
4-methylaeruginoic acid
4-methylimidazole  
4-nitro-1,2-phenylenediamine  
4-nitro-1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine
4-nitro-6-oxohepta-2,4-dienedioic acid
4-nitro-m-cresol  +  
4-nitroacetophenone
4-nitrobenzaldehyde  
4-nitrobenzohydrazide
4-nitrobenzyl alcohol
4-nitrobenzyl bromide  
4-nitrophenyl alpha-L-arabinofuranoside
4-nitrophenyl beta-sophoroside
4-nitrophenyl methylphosphonate
4-nitrophenylalanine  +
4-nitrophenylhydrazine
4-nitrotoluene-2-sulfonic acid
4-phenylbutyric acid  
4-thiouridine
5,10,15,20-tetrakis(1-methylpyridinium-4-yl)porphyrin  
5,5-dimethyl-3-\{[1-(4-nitrophenylsulfonyl)oxy]ethyl\}-dihydro-2(3H)-furanone
5-(p-nitrophenylphosphonate)pentanoic acid
5-[(4-nitrobenzyl)(phosphonomethyl)amino]valeric acid
5-\{[4-(\{hydroxy[(4-nitrophenyl)amino]phosphoryl\}methyl)phenyl]amino\}-5-oxopentanoic acid
5-aminolevulinic acid  +  
5-bromo-2'-deoxyuridine  
5-bromo-8-methoxy-1-methyl-beta-carboline
5-fluoro-2'-deoxyuridine  
5-fluorouracil  
5-hydroxy-2-(1'-hydroxyethyl)naphtho[2,3-b]furan-4,9-dione
5-hydroxy-2-methylchromone-7-O-rutinoside
5-hydroxy-6-methoxy-2-methylchromone-7-O-rutinoside
5-hydroxy-7-prop-2-en-(E)-ylidene-7,7a-dihydro- 2H-cyclopenta[b]pyran-6-one
5-hydroxy-7-prop-2-en-(Z)-ylidene-7,7a-dihydro- 2H-cyclopenta[b]pyran-6-one
5-iodouracil
5-methyl-1H-benzimidazole
5-nitro-o-toluidine
5-nitroimidazole
5-nitrouracil
5-nitrovanillin  +
5-O-ethyl embelin
5-O-methyl embelin
5alpha,8alpha-epidioxycholest-6-en-3beta-ol
5alpha,8alpha-epidioxysterol
6-(3-morpholin-4-ylpropyl)-2-(3-nitrophenyl)-5-thioxo-5,6-dihydro-7H-thieno[2',3':4,5]pyrrolo[1,2-c]imidazol-7-one
6-(4-hydroxy-3-nitrobenzamido)hexanoic acid
6-(4-hydroxy-5-iodo-3-nitrobenzamido)hexanoic acid
6-[(3-bromo-4-hydroxy-5-nitrophenyl)acetamido]caproic acid  +
6-[(4-hydroxy-3-nitrophenyl)acetamido]caproic acid  +
6-[1'-oxo-3'(R)-hydroxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran
6-[1'-oxo-3'(R)-methoxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran
6-\{4-[hydroxy-(4-nitrophenoxy)phosphoryl]butyrylamino\}hexanoic acid
6-\{[5-(p-nitrophenoxy)-5-oxopentanoyl]amino\}hexanoic acid
6-azauracil
6-azauridine
6-hydroxypaclitaxel  
6-methoxyspirotryprostatin B
6-methylthioinosine  
6-methylthiopurine
6-propyl-2-thiouracil  
7,3',4'-trihydroxy-3,8-dimethoxyflavone
7,8-dihydroxyflavanone
7-(4''-hydroxy-3''-methoxyphenyl)-1-phenyl-4E-heptene-3-one
7-(4''-hydroxy-3''-methoxyphenyl)-5-methoxy-1-phenyl-3-heptanone
7-amino-1-(5-nitro-2-furyl)-1,8-dioxo-11,14,17,20,23-pentaoxa-2-azahexacosan-26-amide
7-methoxydeoxymorellin
7-oxo-3,8,9-trihydroxy staurosporine
7-oxo-8,9-dihydroxy-4'-N-demethyl staurosporine
7alpha-hydroperoxy manool
8,8a-epoxymorellic acid
8-azaguanine  
8-hydroxy-2-(1'-hydroxyethyl)naphtho-[2,3-b]-furan-4,9-dione
9(11)-dehydroaxinysterol
9-(5-phosphoribofuranosyl)-6-mercaptopurine
9-[(5E)-5,6,7-trideoxy-7-\{[(2,3-dihydroxy-5-nitrophenyl)carbonyl]amino\}-beta-D-ribo-hept-5-enofuranosyl]adenine
9-beta-D-arabinofuranosylguanine  +
9-cis-retinoic acid  +  
9-deacetoxyfumigaclavine C
9-hydroxy hedychenone
9-hydroxycanthin-6-one
9-methoxycanthin-6-one
[(2S,4S)-2-[(1R)-1-amino-2-hydroxyethyl]-4-(1H-imidazol-4-ylmethyl)-5-oxoimidazolidin-1-yl]acetic acid
\{[5-(5-nitro-2-furyl)-1,3,4-oxadiazol-2-yl]thio\}acetic acid
abarelix
abiraterone  +
abiraterone acetate
abyssinone A
abyssinone C
abyssinone D
acenocoumarol  +  
acifluorfen  
acronycine
aculeatol E
acumitin
acyclovir  
afatinib
afimoxifene  
agathisflavone
ageladine A
agigenin  +
aklavinone
albizoside A
albizoside B
albizoside C
alfuzosin  +  
all-trans-retinoic acid  +  
allanxanthone C
allopurinol  
alosetron  +
alvaradoin E
alvaradoin F
alvaradoin G
alvaradoin H
alvaradoin I
alvaradoin J
alvaradoin K
alvaradoin L
alvaradoin M
alvaradoin N
aminoglutethimide  +  
aminoimidazole  +  
amocarzine
amomol A
amoscanate
anastrozole  
andrographolide  
ansamitocin P3
antroquinonol
aphidicolin  
apigenin  +  
aplysinoplide A
aplysinoplide B
aplysinoplide C
apratoxin A
apratoxin D
apratoxin E
ardisianoside A
ardisianoside B
ardisianoside C
ardisianoside D
ardisianoside E
ardisiphenol A
ardisiphenol B
ardisiphenol C
arenamide A
arenamide B
aristolochic acid  
artocarpin
artochamin C
artoindonesianin E1
artoindonesianin P
asperfuranone
aspergillide A
aspergillide B
aspergillide C
asprellic acid A
asprellic acid C
axitinib
azelaic acid  
BE-54238A
BE-54238B
belinostat
beta-elemene  +
beta-lapachone  
beta-thujaplicin
betulin  +  
betulinic acid  +  
bexarotene
BF 4
BF 5
BF 6
BGJ-398
BGT226
BGT226 free base
bicalutamide  
bicyclic nitroimidazole  +
bielschowskysin
bistratamide E
bistratamide F
bistratamide G
bistratamide H
bistratamide I
bistratamide J
BKM120
bleomycin A2  
bleomycin B2
BML-210
bortezomib
bosutinib  +
bosutinib hydrate
bowdichione
brasilicardin A
brasiliquinone A
brasiliquinone B
brasiliquinone C
brasixanthone B
brasixanthone C
brasixanthone D
brevipolide A
brevipolide B
brimonidine  +  
bromophycolide A
bufalin  
busulfan  
butein  
butoconazole  +
butoconazole nitrate  +
cabazitaxel
cabergoline  
cabozantinib  +
cabozantinib malate
cadiyenol
calcitriol  +  
calicheamicin gamma1(I)
callophycoic acid A
callophycoic acid C
callophycoic acid D
callophycoic acid E
callophycoic acid F
callophycoic acid G
callophycoic acid H
callophycol A
callophycol B
calotropone
camptothecin  
canertinib
capecitabine  
capilliposide B
carbimazole  
carboplatin  
cardivin A
cardivin B
cardivin C
cardivin D
carfilzomib
carmustine  
carnosic acid  
caseamemebrol A
caseamemebrol B
caseanigrescen A
caseanigrescen B
caseanigrescen C
caseanigrescen D
caudatin-3-O-beta-cymaropyranoside
celastrol  
celebixanthone  +
cembra-2,7,11-triene-4,6-diol
cerulenin  
cetrorelix  +  
cetrorelix acetate
CH5424802
chloropicrin  
chlorotrianisene  
cidofovir anhydrous  +  
cidofovir dihydrate
ciglitazone  
ciliatamide B
cimetidine  +  
cisplatin  
cladoniamide G
cladribine  
clavulone II
clionastatin A
clionastatin B
clobenpropit  
clodronic acid  
clofarabine  
clofibric acid  +  
clotrimazole  
colpol
cordycepin  +  
cordycepin triphosphate
cordyol C
corynoline
costunolide  
crassumolide A
cratoxyarborenone A
cratoxyarborenone B
cratoxyarborenone C
cratoxyarborenone D
cratoxyarborenone E
cratoxyarborenone F
crizotinib
cudratricusxanthone A
curcumin  +  
cyclodepsipeptide 2
cyclophosphamide  +  
cyclophosphamide hydrate
cystodytin D  +
cystodytin E  +
cystodytin F
cystodytin G
cystodytin H
cystodytin I
cystothiazole A
cytarabine  
cytotrienin A
D-erythro-1-(imidazol-4-yl)glycerol 3-phosphate
dacarbazine  
dactolisib
daidzein  +  
dasatinib (anhydrous)  +  
dasatinib monohydrate
decursinol
dehydrocostus lactone  
delphinidin  +  
demethoxycurcumin  
devazepide  
dexamethasone  +  
dexrazoxane hydrochloride
dianversicoside A
dianversicoside B
dianversicoside C
dianversicoside D
dianversicoside E
dianversicoside F
dianversicoside G
diarsenic trioxide  
dicerandrol A
dicerandrol B
dicerandrol C
didanosine  
diethylstilbestrol  +  
dinochrome A
diosmetin  
diuvaretin
docetaxel anhydrous  +  
docetaxel trihydrate
doxazosin  +  
dromostanolone propionate
E-3810
E-3810 free base
econazole  
elaeodendroside B
elaeodendroside F
elaeodendroside G
elaeodendroside T
elaeodendroside U
elaeodendroside W
elephantin
elongatol A
elongatol E
emarginatine B
emarginatine F
embelin  +  
emodin  +  
englerin A
enrofloxacin
ent-kaur-16-en-19-oic acid
enzalutamide
eosin b diphenol
epothilone A
ergosterol peroxide  
eribulin
eribulin mesylate
erlotinib  +
erlotinib hydrochloride
erybraedin A
esculeoside A
esperamicin A1
estramustine  +  
estrone  +  
etidronic acid  
etomidate  
etoposide  
eugeniin
eupaheliangolide A
eupatilin  
euphornin L
eurysterol A
eurysterol A sulfonic acid
eurysterol B
eurysterol B sulfonic acid
everolimus  
exemestane  
ezetimibe  
F390B
F390C
FD-211
flavokawain B
fludarabine phosphate
fluoxymesterone  
flutamide  
formycin A  +
FR901463
FR901464
FR901465
fulvestrant  
furazolidone  
fuzanin D
gaudichaudiic acid F
gaudichaudiic acid G
gaudichaudiic acid H
gaudichaudiic acid I
gedunin  
gefitinib  +  
geldanamycin  +  
gelomulide K
gelomulide M
gemcitabine  +
gemcitabine hydrochloride
genistein  +  
gilvusmycin
ginkgetin
glionitrin A
globostellatic acid A
globostellatic acid B
globostellatic acid C
globostellatic acid D
glochierioside A
glochierioside B
glycidyl 2,2-dinitropropyl formal
gnidilatimonoein
granaticin
grassypeptolide
GSK1059615
gummiferaoside A
gummiferaoside B
gummiferaoside C
hadacidin
HC toxin
hedychilactone D
heliangin
hesperetin  +  
hinokiflavone
histamine  +  
histaminium
histidine  +
histidine derivative  +  
histrelin  +
histrelin acetate
horminone  +
hydroxytyrosol  +  
hyperxanthone C
hyperxanthone E
hypocrellin D
IC202B
idazoxan  +  
ifosfamide  
igalan
imatinib  +  
imatinib methanesulfonate
imetit  
imidazole  +  
imidazole-4-methanol
imidazolone  +
imidazolyl carboxylic acid  +  
imidazolyl carboxylic acid anion  +
imidazolylacetaldehyde  +
imiquimod  
ingenol mebutate
isariotin F
isochamuvaritin
isoiguesterin
isoorientin  +  
isotretinoin  
isowigtheone hydrate
ixabepilone
ixerochinolide
jaceosidin
jaspamide  
jaspamide B
jaspamide C
jaspamide D
jaspamide E
jaspamide F
jaspamide G
jaspamide H
jaspamide J
jaspamide K
jaspamide L
jaspamide M
jaspamide N
jaspamide O
jaspamide P
jerantinine A  +
jerantinine B
jerantinine C  +
jerantinine D
jerantinine E
jerantinine F
jineol
juglanin A
juglanin B
kadlongilactone A
kadlongilactone B
kaempferol 7-O-(2,3-di-E-p-coumaroyl-alpha-L-rhamnopyranoside)
kaempferol 7-O-(2-E-p-coumaroyl-alpha-L-rhamnopyranoside)
kansuiphorin A
kansuiphorin B
ketoconazole  +  
kidjoranin-3-O-alpha-diginopyranosyl-(1->4)-beta-cymaropyranoside
kidjoranin-3-O-beta-digitoxopyranoside
kievitone  +
kitastatin 1
knipholone  +
koshikamide A2
kweichowenol B
L-ethionine  +  
L-histidinal
L-histidinol  +
lapatinib
laurebiphenyl
leachianone A
leflunomide  
lenalidomide  
letrozole  
leucospiroside A
leuprolide  +  
leuprolide acetate
liriodenine
lofexidine
longicalycinin A
losartan  
lovastatin  
lucanthone  +  
lucialdehyde B
lucialdehyde C
lucidenic acid N
luteolin  +  
luzonial A
luzonial B
luzonidial B
lychnostatin 1
lychnostatin 2
lyratol C
lyratol D
maackiaflavanone A
maackiaflavanone B
maackiapterocarpan A
macaflavanone G
macaranone A
macluraxanthone B
macluraxanthone C
manassantin A
manassantin B
manzamine A  +
maoecrystal Z
marimastat
marineosin A
marineosin B
masitinib
maslinic acid  +
maytenfolone A
mechlorethamine hydrochloride
medetomidine  +  
megathyrin A
megestrol  +  
melophlin P
melophlin Q
melophlin R
melophlin S
melphalan  
mercaptopurine  +  
mesotrione
metachromin S
metachromin T
methimazole  +  
metholone  +
methotrexate  
methoxsalen  +  
methyl (indol-3-yl)acetate
methyl 5-aminolevulinate  +
methyl 5-aminolevulinate hydrochloride
methylselenol
methyltestosterone  
metronidazole  +  
metyrapone  
miboplatin
michaolide A
michaolide B
michaolide C
michaolide D
michaolide E
michaolide F
michaolide G
michaolide H
michaolide I
michaolide J
michaolide K
miconazole  
microclavatin
midostaurin  
migrastatin
minheryin G
minquartynoic acid
miserotoxin
mithramycin  
mitoxantrone  +  
mitoxantrone dihydrochloride
monodictyochromone A
monodictyochromone B
monodictysin B
monodictysin C
morellic acid  +
morellin  +
moromycin A
moromycin B
MTIC
mycophenolic acid  +  
myo-inositol hexakisphosphate  
myriaporone 3
myricetin  +  
myrsinoic acid A
N(1),N(5)-bis(2-deoxy-beta-D-glucopyranos-2-yl)-N(2)-(N(3)-DNCP-beta-alanyl)glutaminamide
N(1),N(6)-bis-DNCP-1,6-hexanediamine
N(2)-[3-(2-\{2-[(\{1-[(1-\{3-[2-(2-\{[4-(indol-3-yl)butanoyl]amino\}ethoxy)ethoxy]propanoyl\}piperidin-4-yl)carbonyl]piperidin-4-yl\}carbonyl)amino]ethoxy\}ethoxy)propanoyl]-N(6)-(5-nitro-2-furoyl)lysinamide
N(2)-\{3-[2-(2-\{[(1-\{3-[2-(2-\{[4-(indol-3-yl)butanoyl]amino\}ethoxy)ethoxy]propanoyl\}piperidin-4-yl)carbonyl]amino\}ethoxy)ethoxy]propanoyl\}-N(6)-(5-nitro-2-furoyl)lysinamide
N(2)-\{3-[2-(2-\{[(1-\{N-[(1-\{3-[2-(2-\{[4-(indol-3-yl)butanoyl]amino\}ethoxy)ethoxy]propanoyl\}piperidin-4-yl)carbonyl]glycyl\}piperidin-4-yl)carbonyl]amino\}ethoxy)ethoxy]propanoyl\}-N(6)-(5-nitro-2-furoyl)lysinamide
N(6)-(2,4-dinitrophenyl)lysine  +
N(6)-(Delta(2)-isopentenyl)adenosine  +
N(6)-(N(6)-\{6-[(5-nitro-2-furoyl)amino]hexanoyl\}lysyl)lysyl-N(6)-[4-(indol-3-yl)butanoyl]lysinamide
N(6)-[N(6)-(N(6)-\{6-[(5-nitro-2-furoyl)amino]hexanoyl\}lysyl)lysyl]lysyl-N(6)-[4-(indol-3-yl)butanoyl]lysinamide
N(tele)-methylhistamine  
N-(18-amino-18-oxo-3,6,9,12,15-pentaoxaoctadec-1-yl)-N(2)-\{3-[2-(2-\{[(1-\{[1-(\{1-[(1-\{3-[2-(2-\{[4-(indol-3-yl)butanoyl]amino\}ethoxy)ethoxy]propanoyl\}piperidin-4-yl)carbonyl]piperidin-4-yl\}carbonyl)piperidin-4-yl]carbonyl\}piperidin-4-yl)carbonyl]amino\}ethoxy)ethoxy]propanoyl\}-N(6)-(5-nitro-2-furoyl)lysinamide
N-(2,4-dinitro-6-carboxy)phenyl-1.6-diaminohexane
N-(2,4-dinitrophenyl)-L-proline
N-(2,4-dinitrophenyl)-L-serine
N-(2,4-dinitrophenyl)aminohexanoic acid
N-(2,4-dinitrophenyl)proline
N-(2,4-dinitrophenyl)serine
N-(4-\{hydroxy[(4-nitrobenzyl)oxy]phosphoryl\}butanoyl)glycine
N-(p-nitrophenylphosphobutanoyl)glycine
N-(trans-4'-nitro-4-stilbenyl)-N-methyl-5-aminopentanoic acid
N-[(3-nitro-4-\{[2-(phenylsulfanyl)ethyl]amino\}phenyl)sulfonyl]-4-[2-(2-phenylethyl)-1,3-benzothiazol-5-yl]benzamide
N-[(4-\{[1,1-dimethyl-2-(phenylthio)ethyl]amino\}-3-nitrophenyl)sulfonyl]-4-(4,4-dimethylpiperidin-1-yl)benzamide
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide
N-[2-morpholin-4-yl-1-(morpholin-4-ylmethyl)ethyl]-3-nitro-5-(3,4,5-trihydroxy-6-hydroxymethyltetrahydropyran-2-yloxy)benzamide
N-[5-(p-nitrobenzyloxy)-5-oxopentanoyl]glycine
N-[5-(p-nitrophenoxy)-5-oxopentanoyl]glycine
N-[6-(DNCP-amino)hexanoyl]-beta-D-glucosamine
N-\{1-amino-6-[(5-nitro-2-furoyl)amino]-1-oxohexan-2-yl\}-23-(indol-3-yl)-20-oxo-4,7,10,13,16-pentaoxa-19-azatricosan-1-amide
N-\{1-amino-6-[(5-nitro-2-furoyl)amino]-1-oxohexan-2-yl\}-26-(indol-3-yl)-23-oxo-4,7,10,13,16,19-hexaoxa-22-azahexacosan-1-amide
N-\{1-amino-6-[(5-nitro-2-furoyl)amino]-1-oxohexan-2-yl\}-32-(indol-3-yl)-29-oxo-4,7,10,13,16,19,22,25-octaoxa-28-azadotriacontan-1-amide
N-\{1-amino-6-[(5-nitro-2-furoyl)amino]-1-oxohexan-2-yl\}-80-(indol-3-yl)-77-oxo-4,7,10,13,16,19,22,25,28,31,34,37,40,43,46,49,52,55,58,61,64,67,70,73-tetracosaoxa-76-azaoctacontan-1-amide
N-\{3-[4-(3-aminopropyl)piperazin-1-yl]propyl\}-3-nitro-5-(D-galactopyranosyl)benzamide  +
N-acylimidazole  +
N-arylimidazole  +
N-desmethylenzalutamide
N-ethyl-5'-carboxamidoadenosine  
N-hydroxyguanidine
naringin  
nelarabine
neobavaisoflavone  +
neocarzinostatin chromophore
neohesperidin
neratinib
nidulalin A
nigranoic acid
nilotinib
nilutamide  
nitarsone
nitenpyram  +
nitensidine E
nitroanisoles  +  
nitrofurantoin  
nitrohydrocarbon  +  
nitropyrimidine  +
nitrotoluene  +  
nitroxoline
NK154183A
NK154183B
nogalamycin
norathyriol  
Nutlin  +
O(3)-(2-L-lysino-2-oxoethyl)-O(1)-[4-(trifluoroacetamido)benzylcarbonyl]chloramphenicol
O-(2-aminoethyl)-L-serine
O-(4-trifluoroacetamidobenzylphosphonyl)chloramphenicol
obochalcolactone
obolactone
obyanamide
ochrocarpin A
ochrocarpin B
ochrocarpin C
ochrocarpin D
ochrocarpin E
ochrocarpin F
ochrocarpin G
ochrocarpinone A
ochrocarpinone B
oleanolic acid 3-O-[O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->3)-O-alpha-L-rhamnopyranosyl-(1->2)-alpha-L-arabinopyranoside]
omacetaxine mepesuccinate  
orbiculin A
orbiculin E
orbiculin F
orbiculin G  +
oroxylin A  +  
oryzalin
ospemifene
oxaliplatin  +  
oxmetidine
oxypeucedanin hydrate acetonide
p-nitrobenzyl glutaryl glycinic acid
paclitaxel  +  
palau'amide
pasireotide
pasireotide aspartate
pazopanib
pazopanib hydrochloride
PD173074
pemetrexed  
pemetrexed disodium  +
pemetrexed disodium heptahydrate
pentachloronitrobenzene  
perillic acid  +  
phenethyl isothiocyanate  
phomacin A
phomacin B
phomacin C
picric acid  +
piperidinylimidazole  +
PK-11195
pleosporone
plumbagin  
PM-94128
podophyllotoxin  +  
poly(N-vinylimidazole) macromolecule  +
polyketomycin
pomalidomide
porfimer
porfimer sodium
pralatrexate
prednisolone  +  
prednisone  +  
procarbazine  
procarbazine hydrochloride
procyanidin B4
pterostilbene  
puromycin  +  
quassimarin
quercetin  +  
quercetin 3,4'-dimethyl ether
rediocide G
regorafenib  +
regorafenib hydrate
respirantin
retaspimycin
retaspimycin hydrochloride
reversine
rhinacanthin C
rhizoxin
ribavirin  
robustaflavone  +
robustaflavone 7,4',7''-trimethyl ether
rocaglamide
romidepsin  
rostratin A
rostratin B
rostratin C
rostratin D
rotenone  
rotundifolioside A
rotundifolioside H
rotundifolioside I
rotundifolioside J
roxarsone  
rubraxanthone
ruxolitinib  +
ruxolitinib phosphate
salvileucalin B
samaderine B
samaderine C
samaderine E
samaderine X
samaderine Y
samaderine Z
schiprolactone A
schizolaenone A
schizolaenone B
schweinfurthin G
schweinfurthin H
scutellarin  
scytalidamide A
scytalidamide B
Se-methyl-L-selenocysteine  +  
Se-methylselenocysteine  +  
silibinin  
sirolimus  +  
sodium 2-amino-5-[(1-methoxy-2-methylindolizin-3-yl)carbonyl]benzoate
sodium globostellatate B
sodium globostellatate A
sodium globostellatate C
sodium globostellatate D
sodium stibogluconate
sorafenib  +
stavudine  
streptokordin
streptonigrin  
streptozocin  
sulindac  +  
sunitinib  +
surfactin  
surfactin A  +  
surfactin B  +  
surfactin C  +  
surfactin D  +  
swainsonine
tabersonine  +
tamibarotene  
tamoxifen  +  
tamsulosin  +  
tanespimycin
tangeretin  
temozolomide  
tephrosin  +  
terazosin  +  
terrequinone A
thiostrepton
tinidazole
tioguanine  
tizanidine  
TMC-135A
TMC-135B
TMC-1A
TMC-1B
TMC-1C
TMC-1D
TMC-86A
TMC-86B
TMC-95A
TMC-95B
TMC-95C
TMC-95D
TMC-96
TNP-ATP
tolazoline  
topopyrone A
topopyrone B
topopyrone C
topopyrone D
topotecan  
toremifene  
trans-2-hydroxyisoxypropyl-3-hydroxy-7-isopentene-2,3-dihydrobenzofuran-5-carboxylic acid
tricetin  +  
trichodermin
trierixin
trilostane
triptorelin  
troglitazone  
tubercidin  +
ubiquinol-8
UCS1025 A
urdamycin A
vandetanib  +
vedelianin  +
vemurafenib
verteporfin  
vindesine  +  
vindesine sulfate
vinorelbine  +  
vinorelbine D-tartrate
vinorelbine L-tartrate
vismodegib
vitexin  +
wedelolactone  
wogonin  +  
WZ4002
xi,xi-pilocarpine  +  
XL147
XL765
zalcitabine  
zidovudine  
zoledronic acid