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

Drug Details

add
Name:CHEMBL331129
PubChem ID:44342895
Pathway:-
InChI:InChI=1S/C31H40N4O2/c1-22(2)30(31(36)37)35-20-26(27(21-35)24-11-7-4-8-12-24)19-34-15-13-25(14-16-34)28-18-32-29(33-28)17-23-9-5-3-6-10-23/h3-12,18,22,25-27,30H,13-17,19-21H2,1-2H3,(H,32,33)(H,36,37)/t26-,27?,30?/m0/s1
SMILES:CC(C(N1CC([C@H](C1)CN1CCC(CC1)c1cnc([nH]1)Cc1ccccc1)c1ccccc1)C(=O)O)C

Properties:
Formula:C31H40N4O2Atoms:37
Molecular Weight:500.675Rotatable Bonds:9
H-bond Acceptors:5H-bond Donors:2
logP:4.8805
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:289949
CHEMBL331129