Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:Dabigatran
PubChem ID:216210
Pathway:-
InChI:InChI=1/C25H25N7O3/c1-31-20-10-7-17(25(35)32(13-11-23(33)34)21-4-2-3-12-28-21)14-19(20)30-22(31)15-29-18-8-5-16(6-9-18)24(26)27/h2-10,12,14,29H,11,13,15H2,1H3,(H3,26,27)(H,33,34)/f/h26,33H,27H2/b26-24-
SMILES:Cn1c2ccc(cc2nc1CNc1ccc(cc1)/C(=N\[H])N)C(N(CCC(O)=O)c1ccccn1)=O

Properties:
Formula:C25H25N7O3Atoms:36
Molecular Weight:471.511Rotatable Bonds:10
H-bond Acceptors:8H-bond Donors:1
logP:3.859
Targets:
Synonyms:
.beta.-Alanine,
211914-51-1
BIBR 953
BIBR 953, Dabigatran, BIBR953
BIBR 953ZW
BIBR-953
BIBR-953ZW
Dabigatran
Dabigatran [INN]
N-((2-((p-Amidinoanilino)methyl)-1-methyl-5-benzimidazolyl)carbonyl)-N-2-pyridyl-beta-alanine