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

Drug Details

add
Name:CHEMBL1085722
PubChem ID:46890429
Pathway:-
InChI:InChI=1S/C37H51N7O3/c1-5-47-31-11-9-28(10-12-31)24-42-25-33(32-8-6-7-17-39-32)44(36(42)46)30-13-18-43(19-14-30)37(4)15-20-41(21-16-37)35(45)34-26(2)22-29(23-38)40-27(34)3/h6-8,17,22,28,30-31,33H,5,9-16,18-21,24-25H2,1-4H3
SMILES:CCOC1CCC(CC1)CN1C[C@@H](N(C1=O)C1CCN(CC1)C1(C)CCN(CC1)C(=O)c1c(C)cc(nc1C)C#N)c1ccccn1

Properties:
Formula:C37H51N7O3Atoms:47
Molecular Weight:641.846Rotatable Bonds:9
H-bond Acceptors:10H-bond Donors:0
logP:5.24998
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:732190
CHEMBL1085722