DrugBank ID
stringlengths
7
7
Accession Numbers
stringlengths
7
102
Common name
stringlengths
3
226
CAS
stringlengths
7
12
UNII
stringlengths
10
10
Synonyms
stringlengths
2
1.48k
Standard InChI Key
stringlengths
27
27
DB01789
EXPT00430
1-Amino-2,3-Dihydroxy-5-Hydroxymethyl Cyclohex-5-Ene
null
null
null
BMZJPVSGERKRHP-ACZMJKKPSA-N
DB01790
EXPT02808 | EXPT02940
(Rp)-cAMPS
null
null
(Rp)-adenosine-3',5'-cyclic monophosphorothioate | adenosine-3',5'-cyclic monophosphorothioate, Rp-isomer | Rp-cAMPS
SMPNJFHAPJOHPP-PUHOFUEYSA-N
DB01791
EXPT02600
Piclamilast
144035-83-6
WM58D7C3ZT
3-(cyclopentyloxy)-N-(3,5-dichloro-4-pyridinyl)-4-methoxybenzamide | 3-(cyclopentyloxy)-N-(3,5-dichloro-4-pyridyl)-p-anisamide | Piclamilast | Piclamilastum
RRRUXBQSQLKHEL-UHFFFAOYSA-N
DB01792
EXPT00547
Adenylyl-(3'-5')-uridine 3'-monophosphate
1985-21-3
null
Adenylyl-(3'-5')-3'-uridylic acid | Adenylyl-3'-5'-phospho-uridine-3'-monophosphate
FZCSEXOMUJFOHQ-KPKSGTNCSA-N
DB01793
EXPT00277
SB-409513
null
null
I-5
ONVZFCHLOZUXRP-UHFFFAOYSA-N
DB01794
EXPT02688
bis(molybdopterin)tungsten cofactor
null
null
Tungstopterin | W-molybdopterin cofactor
TXTOFHXWJBZWPO-UHFFFAOYSA-F
DB01795
EXPT02505
Phenylboronic acid
98-80-6
L12H7B02G5
Benzeneboronic acid | Borophenylic acid | dihydroxy(phenyl)borane | Phenyldihydroxyborane
HXITXNWTGFUOAU-UHFFFAOYSA-N
DB01796
EXPT02391
Quinolinic Acid
89-00-9
F6F0HK1URN
null
GJAWHXHKYYXBSV-UHFFFAOYSA-N
DB01797
EXPT01014
(2R)-2-(aminomethyl)-2,4-dihydroxy-5-oxo-3-(2-oxoethyl)-2,5-dihydro-1H-imidazol-3-ium
null
null
null
IMYOMVNQPPPJHU-ZCFIWIBFSA-O
DB01798
EXPT02470
Ethyl Dihydrogen Diphosphate
null
null
null
OJDJHGIXNZPZFD-UHFFFAOYSA-N
DB01799
EXPT01334
4-Hydroxy-3-Methyl Butyl Diphosphate
null
null
null
URURINNTPGGDIV-YFKPBYRVSA-N
DB01800
EXPT01034
4-Nitrocatechol sulfate
10485-66-2
HD9MHQ536A
2-hydroxy-5-nitrophenyl hydrogen sulfate | 2-Hydroxy-5-nitrophenyl sulfate | p-Nitrocatechol sulfate | para-Nitrocatechol sulfate
XMCCOOONGGUOLA-UHFFFAOYSA-N
DB01802
EXPT00307
(4R)-7-Aza-7,8-dihydrolimonene
null
null
null
LDFVYCXKPXXSNO-VIFPVBQESA-N
DB01803
EXPT01369
2-(Trimethylammonium)Ethyl Thiol
null
null
null
VFUGTBZQGUVGEX-UHFFFAOYSA-O
DB01804
EXPT00367
2-Ammoniobut-3-Enoate, 2-Amino-3-Butenoate
null
null
null
RQVLGLPAZTUBKX-GSVOUGTGSA-N
DB01805
EXPT02178
Monoisopropylphosphorylserine
null
null
null
DALHHSOTZKMXMV-YFKPBYRVSA-N
DB01806
EXPT00481
10-decarboxymethylaclacinomycin A
null
null
DCMAA
OXPCRXLITLBLEY-ZVNFQBCFSA-N
DB01807
EXPT01987
N-[(3Z)-5-Tert-butyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-ylidene]-N'-(4-chlorophenyl)urea
null
null
null
XIWRCSVXKPGGAJ-UHFFFAOYSA-N
DB01808
EXPT01089
Thiarsahydroxy-Cysteine
null
null
null
SHJQITKLZDPXCU-REOHCLBHSA-N
DB01809
EXPT02633
1-Ter-Butyl-3-P-Tolyl-1h-Pyrazolo[3,4-D]Pyrimidin-4-Ylamine
null
SA2ND7EHY4
null
ZVPDNRVYHLRXLX-UHFFFAOYSA-N
DB01810
EXPT00058
[1-(1-Methyl-4,5-Dioxo-Pent-2-Enylcarbamoyl)-2-Phenyl-Ethyl]-Carbamic Acid Benzyl Ester
null
null
null
NOXVWFAAXREWMI-GURWAVDKSA-N
DB01811
EXPT00174
3h-Indole-5,6-Diol
3131-52-0
Z3OC8499KG
null
SGNZYJXNUURYCH-UHFFFAOYSA-N
DB01812
EXPT00370
Adenosine 3',5'-diphosphate
1053-73-2
C65F80D52U
3'-Phosphoadenosine 5'-phosphate | 3',5'-ADP | Adenosine 3'-phosphate-5'-phosphate | Adenosine 3',5'-bismonophosphate | Phosphoadenosine phosphate
WHTCPDAXWFLDIH-KQYNXXCUSA-N
DB01813
EXPT02638 | EXPT02576
Pyridoxyl-Glutamic Acid-5'-Monophosphate
null
null
null
JMRKOGDJNHPMHS-JTQLQIEISA-O
DB01814
EXPT02033
2-Tridecanoyloxy-Pentadecanoic Acid
null
null
null
WLKQLKMXKFGMQI-SANMLTNESA-N
DB01815
EXPT02041
Nz-(Dicarboxymethyl)Lysine
null
null
null
XINFXVVRMYBFMI-YFKPBYRVSA-N
DB01816
EXPT01055
Castanospermine
79831-76-8
Q0I3184XM7
(1S-(1α,6β,7α,8β,8αβ))-octahydro-1,6,7,8-indolizinetetrol | (1S,6S,7R,8R,8aR)-1,6,7,8-tetrahydroxyindolizidine | 1,6,7,8-tetrahydroxyoctahydroindolizine
JDVVGAQPNNXQDW-TVNFTVLESA-N
DB01817
EXPT00445
Threonine-Aspartic Ester
null
null
null
VCAYFLVMRCFGDV-MOJAZDJTSA-N
DB01818
EXPT02894
O3-Sulfonylgalactose
null
null
null
HHRMGTRTCHNCRO-FDROIEKHSA-N
DB01819
EXPT02550
Phosphoenolpyruvate
138-08-9
545YL308OW
null
DTBNBXWJWCWCIK-UHFFFAOYSA-N
DB01820
EXPT00349
2-{[4-(2-Acetylamino-2-pentylcarbamoyl-ethyl)-naphthalen-1-YL]-oxalyl-amino}-benzoic acid
null
null
null
UESXELNYBIOROE-QHCPKHFHSA-N
DB01821
EXPT01252
L-N(omega)-Nitroarginine-2,4-L-diaminobutyric amide
null
null
null
KUZKVXUOMSVPOA-BQBZGAKWSA-N
DB01822
EXPT01282
(4R,5R)-1,2-dithiane-4,5-diol
16096-98-3
3OED5PX4AN
D-4,5-Dihydroxy-1,2-dithiane | Dithiane Diol
YPGMOWHXEQDBBV-IMJSIDKUSA-N
DB01823
EXPT01612
Beta-D-Glucopyranose Spirohydantoin
null
null
null
QRXBDPYWCAAAAI-UXDJRKLDSA-N
DB01824
EXPT00182
(3S)-Tetrahydro-3-furanyl {(2S,3S)-4-[(2S,4R)-4-{(1S,2R)-2-[(S)-amino(hydroxy)methoxy]-2,3-dihydro-1H-inden-1-yl}-2-benzyl-3-oxo-2-pyrrolidinyl]-3-hydroxy-1-phenyl-2-butanyl}carbamate
null
null
null
BYWKHOXUUACYRY-RJAVELRTSA-N
DB01825
EXPT02114
2-amino-8-methyl-4(1H)-quinazolinone
116836-27-2
X6X2DD92TW
null
NLLZAHIPYDRNRQ-UHFFFAOYSA-N
DB01826
EXPT02302
N-Butyl Isocyanide
2769-64-4
2T7Q0CK9IF
null
FSBLVBBRXSCOKU-UHFFFAOYSA-N
DB01827
EXPT00667
2,3,5,6-Tetrafluoro-4-Methoxy-Benzamide
null
null
null
JTXPTSGPUNTKSM-UHFFFAOYSA-N
DB01828
EXPT02363
Methylamine
74-89-5
BSF23SJ79E
null
BAVYZALUXZFZLV-UHFFFAOYSA-N
DB01829
EXPT01129
Desulfo-coenzyme A
5863-40-1
null
Coenzyme A, desulfo | Desulfo-coa
ILWZMFJBPIYQKW-IBOSZNHHSA-N
DB01830
EXPT00856
AP-22408
268741-43-1
3U3L5QR4KV
null
SPSGYTWOIGAABK-DQEYMECFSA-N
DB01831
EXPT03138
Tryptophanyl-5'amp
null
null
null
IFQVDHDRFCKAAW-SQIXAUHQSA-N
DB01832
EXPT01703
4-[Hydroxy-[Methyl-Phosphinoyl]]-3-Oxo-Butanoic Acid
null
null
null
MZTALSPOBPYJPG-UHFFFAOYSA-N
DB01833
EXPT01587
Canavanine
543-38-4
3HZV514J4B
(L)-Canavanine | 2-Amino-4-(guanidinooxy)butyric acid | Canavanin | L-Canavanine | O-((Aminoiminomethyl)amino)-L-homoserine
FSBIGDSBMBYOPN-VKHMYHEASA-N
DB01834
EXPT01641
(9R,10R)-9-(S-glutathionyl)-10-hydroxy-9,10-dihydrophenanthrene
null
null
null
JNNIZILNBMPOAC-MOXQZVSFSA-N
DB01835
EXPT01816
4R-Fluoro-N6-ethanimidoyl-L-lysine
null
null
null
LTCJJIZTKXNFGK-BQBZGAKWSA-N
DB01836
EXPT03286
[4-(6-Chloro-Naphthalene-2-Sulfonyl)-Piperazin-1-Yl]-(3,4,5,6-Tetrahydro-2h-[1,4']Bipyridinyl-4-Yl)-Methanone
null
null
null
ZLAKCKVFSRSENR-UHFFFAOYSA-N
DB01837
EXPT02411
O-acetyl-L-serine
5147-00-2
G05L7T7ZEQ
L-Serine, acetate (ester) | O3-acetyl-L-serine
VZXPDPZARILFQX-BYPYZUCNSA-N
DB01838
EXPT01439
6,4'-Dihydroxy-3-Methyl-3',5'-Dibromoflavone
null
41L058NWH3
null
GKDYOXMZSXVKPP-UHFFFAOYSA-N
DB01839
EXPT02572 | DB11078
Propylene glycol
57-55-6
6DC9Q167V3
1,2-dihydroxypropane | 1,2-Propanediol | 1,2-Propylenglykol | 2-hydroxypropanol | isopropylene glycol | methyl glycol | methylethyl glycol | methylethylene glycol | monopropylene glycol | Propane-1,2-diol | Propylene glycol | α-propyleneglycol
DNIAPMSPPWPWGF-UHFFFAOYSA-N
DB01840
EXPT01100
2-Deoxy-D-Glucitol 6-(E)-Vinylhomophosphonate
null
null
null
CZQSGBWQBMZTMQ-AEVYZNAZSA-N
DB01841
EXPT01604
4,6-Dideoxyglucose
null
null
null
BJBURJZEESAQPG-MOJAZDJTSA-N
DB01842
EXPT02498
3'-Phosphate-Adenosine-5'-Diphosphate
null
null
null
GBBWIZKLHXYJOA-KQYNXXCUSA-N
DB01843
EXPT01596
(5S,7R,8S,9S,10R)-3-Amino-8,9,10-trihydroxy-7-(hydroxymethyl)-6-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
null
null
null
KLJXQBRQPPSXPZ-WWHASAIZSA-N
DB01844
EXPT01224
N,N-dimethylformamide
68-12-2
8696NH0Y2X
Dimethylformamide | N-Formyldimethylamine | N,N-Dimethylmethanamide
ZMXDDKWLCZADIW-UHFFFAOYSA-N
DB01846
EXPT00829
Oxidized coenzyme A
null
null
null
HWMGJMKHOJKGLQ-IBOSZNHHSA-N
DB01847
EXPT00879
N-Carbamyl-D-Valine
null
null
null
JDXMIYHOSFNZKO-SCSAIBSYSA-N
DB01849
EXPT01296
Dihydrouracil
504-07-4
016FR52RU5
2,4-Dioxotetrahydropyrimidine | 5,6-Dihydro-2,4-dihydroxypyrimidine | 5,6-dihydrouracil | Dihydro-2,4(1H,3H)-pyrimidinedione | Dihydrouracile | Hydrouracil
OIVLITBTBDPEFK-UHFFFAOYSA-N
DB01850
EXPT02162
(2S,3S,8S,9S)-3-amino-9-methoxy-2,6,8-trimethyl-10-phenyldeca-4,6-dienoic acid
null
null
null
HJVCHYDYCYBBQX-AWKNMOFVSA-N
DB01851
EXPT03013
Tetrabutylammonium Ion
2052-49-5
CBU2X6BBJR
null
DZLFLBLQUQXARW-UHFFFAOYSA-N
DB01852
EXPT01976
Kaempherol
520-18-3
731P2LE49E
null
IYRMWMYZSQPJKC-UHFFFAOYSA-N
DB01853
EXPT00640
Bacteriochlorophyll A
17499-98-8
null
Bacterio-chlorophyll A
DSJXIQQMORJERS-AGGZHOMASA-M
DB01854
EXPT00757
5-Bromonicotinamide
28733-43-9
FCT9J0CUP7
null
YOQRXZIMSKLRCY-UHFFFAOYSA-N
DB01855
EXPT00682
5-(Hydroxy-Methyl-Amino)-3-Methyl-Pyrrolidine-2-Carboxylic Acid
null
null
null
PGYJBAGGGAUHGV-HSUXUTPPSA-N
DB01856
EXPT02618
Pimelic Acid
111-16-0
BZQ96WX25F
null
WLJVNTCWHIRURA-UHFFFAOYSA-N
DB01857
EXPT00574 | DB03713 | DB04247
Phosphoaspartate
null
null
null
IXZNKTPIYKDIGG-REOHCLBHSA-N
DB01858
EXPT01501
[1-(4-Fluorobenzyl)Cyclobutyl]Methyl (1s)-1-[Oxo(1h-Pyrazol-5-Ylamino)Acetyl]Pentylcarbamate
null
null
null
QTPYRNAKLBXKNP-SFHVURJKSA-N
DB01859
EXPT02978
4-CDP-2-C-methyl-D-erythritol 2-phosphate
263016-95-1
null
2-Phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol
HTJXTKBIUVFUAR-XHIBXCGHSA-N
DB01860
EXPT00163
Cordycepin Triphosphate
73-04-1
59P84ZU54H
null
NLIHPCYXRYQPSD-BAJZRUMYSA-N
DB01861
EXPT01669 | EXPT03198 | DB04355
Uridine diphosphate glucose
133-89-1
V50K1D7P4Y
5'-Diphosphoglucose | Co-galactoisomerase | Co-waldenase | Cogalactoisomerase | UDP-Glucose | UDPG | Uridine 5'-pyrophosphate glucose ester | Uridine-5'-Diphosphoglucose
HSCJRCZFDFQWRP-JZMIEXBBSA-N
DB01862
EXPT01924
Isopropyl beta-D-thiogalactopyranoside
367-93-1
X73VV2246B
IPTG | isopropyl thiogalactoside | isopropyl β-D-1-thiogalactopyranoside | isopropyl β-D-thiogalactopyranoside | isopropyl β-D-thiogalactoside | isopropyl-β-D-thiogalactopyranoside | isopropyl-β-D-thiogalactoside
BPHPUYQFMNQIOC-NXRLNHOXSA-N
DB01863
EXPT01943 | DB03265
Inositol 1,3,4,5-Tetrakisphosphate
null
XK67P86535
null
CIPFCGZLFXVXBG-CNWJWELYSA-N
DB01864
EXPT01651
5'-Guanosine-Diphosphate-Monothiophosphate
37589-80-3
EJ7Q9D2M9D
gamma-Thio-GTP | GTP gamma S | Guanosine 5'-(gamma-S)triphosphate | guanosine 5'-[gamma-thio]triphosphate | Guanosine 5'-O-(3-thiotriphosphate)
XOFLBQFBSOEHOG-UUOKFMHZSA-N
DB01865
EXPT00597
3-(6-Aminopyridin-3-Yl)-N-Methyl-N-[(1-Methyl-1h-Indol-2-Yl)Methyl]Acrylamide
null
null
null
AKFPMLBVLWZSQX-CSKARUKUSA-N
DB01866
EXPT00095
RU79256
null
null
null
USNMCXDGQQVYSW-SSDOTTSWSA-N
DB01868
EXPT02767
Glycyl-L-a-Aminopimelyl-E-(D-2-Aminoethyl)Phosphonate
null
null
null
DREJXTKPUGMERN-YUMQZZPRSA-M
DB01870
EXPT02092
1,4-dithio-alpha-D-glucopyranose
null
null
null
MUOMBPNNVXJUGT-QZABAPFNSA-N
DB01871
EXPT02989
[1-(1-Benzyl-3-Hydroxy-2-Oxo-Propylcarbamoyl)-2-Phenyl-Ethyl]-Carbamic Acid Benzyl Ester
null
null
null
OACUXIVGLLCILS-ZEQRLZLVSA-N
DB01872
EXPT02337
2-deoxy-2-acetamido-beta-D-galactose-4-sulfate
null
null
null
WHCJUIFHMJFEFZ-UIAUGNHASA-N
DB01873
EXPT01350
Epothilone D
189453-10-9
T0358E0YUF
(-)-desoxyepothilone B | 12,13-desoxyepothilone B | Desoxyepothilone B
XOZIUKBZLSUILX-GIQCAXHBSA-N
DB01874
EXPT03077
Tropinone
532-24-1
2A8CC8KA5F
null
QQXLDOJGLXJCSE-KNVOCYPGSA-N
DB01875
EXPT00599
8-azaxanthine
1468-26-4
97MRZ3ZY2U
Xanthazol
KVGVQTOQSNJTJI-UHFFFAOYSA-N
DB01876
EXPT00626
Bis(5-Amidino-2-Benzimidazolyl)Methanone
null
null
null
VVVXDHROXQUONB-UHFFFAOYSA-N
DB01877
EXPT02941
N-Hydroxy 1n(4-Methoxyphenyl)Sulfonyl-4-(Z,E-N-Methoxyimino)Pyrrolidine-2r-Carboxamide
null
null
null
OJLWCTMBGWSVFC-JOYOIKCWSA-N
DB01878
EXPT00794
Benzophenone
119-61-9
701M4TTV9O
Benzophenone | Benzoylbenzene | Diphenyl ketone | Diphenylmethanone | α-oxodiphenylmethane | α-oxoditane
RWCCWEUUXYIKHB-UHFFFAOYSA-N
DB01879
EXPT03011
(S)-2-{Methyl-[2-(Naphthalene-2-Sulfonylamino)-5-(Naphthalene-2-Sulfonyloxy)-Benzoyl]-Amino}-Succinicacid
null
null
null
JOAALZBSMWLOPQ-LJAQVGFWSA-N
DB01880
EXPT01188
3,4-Dihydroxycinnamic Acid
331-39-5
U2S3A33KVM
null
QAIPRVGONGVQAS-DUXPYHPUSA-N
DB01881
EXPT02229
2-Methylpentane-1,2,4-Triol
null
null
null
OMXLSJPESIOAGG-WDSKDSINSA-N
DB01882
EXPT02085
(2s)-2-Amino-4-(Methylsulfanyl)-1-Pyridin-2-Ylbutane-1,1-Diol
null
null
null
JPZQHIBHGCCNKS-QMMMGPOBSA-N
DB01883
EXPT02874
N-(Sulfanylacetyl)Tyrosylprolylmethioninamide
null
null
null
LNLWXWOYQHAKTD-ULQDDVLXSA-N
DB01884
EXPT00369
2-Amino-3-Methyl-1-Pyrrolidin-1-Yl-Butan-1-One
null
null
null
IHBAVXVTGLANPI-QMMMGPOBSA-N
DB01885
EXPT00035
D-Galctopyranosyl-1-On
15892-28-1
null
null
PHOQVHQSTUBQQK-MGCNEYSASA-N
DB01887
EXPT00659
N,N-[2,5-O-Dibenzyl-glucaryl]-DI-[1-amino-indan-2-OL]
null
null
Inhibitor BEA369
HLBCBFBFJWGTFR-QKXNMUHCSA-N
DB01888
EXPT01046
4-[5-(Trans-4-Aminocyclohexylamino)-3-Isopropylpyrazolo[1,5-a]Pyrimidin-7-Ylamino]-N,N-Dimethylbenzenesulfonamide
null
null
null
MDIWBYRNTPTYQI-QAQDUYKDSA-N
DB01889
EXPT00580
16,17-Androstene-3-Ol
7148-51-8
48K9VAM062
null
KRVXMNNRSSQZJP-PHFHYRSDSA-N
DB01890
EXPT01003
N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide
86303-23-3
8A64ND3B39
D-Gluconamide, N,N'-((((3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propanediyl)bis- | Deoxy-bigchap | N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide | N,N'-((((3alpha,5beta,12alpha)-3,12-Dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propandiyl)bis-D-gluconamide
OJSUWTDDXLCUFR-HGZMBBKESA-N
DB01891
EXPT01893
Tl-3-093
null
null
null
QLOIOASGERKBSU-NYVOZVTQSA-N
DB01892
EXPT01804
Hyperforin
11079-53-1
RM741E34FP
Hiperforina | Hyperforine
IWBJJCOKGLUQIZ-HQKKAZOISA-N
DB01893
EXPT02305
N6-Benzyl Adenosine-5'-Diphosphate
null
null
null
MRHGMAGSDAQUFH-LSCFUAHRSA-N
DB01895
EXPT00511
Aspartyl-Adenosine-5'-Monophosphate
null
null
null
QPBSGQWTJLPZNF-VWJPMABRSA-N