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

Drug Details

add
Name:CHEMBL1288879
PubChem ID:52947064
Pathway:-
InChI:InChI=1S/C40H47ClF5N5O4S/c1-5-18-51(37(53)47-30-11-9-27(10-12-30)40(44,45)46)31-13-19-49(20-14-31)21-15-39(28-7-6-8-29(42)24-28)16-22-50(23-17-39)36(52)32-25-35(34(43)26-33(32)41)56(54,55)48-38(2,3)4/h5-12,24-26,31,48H,1,13-23H2,2-4H3,(H,47,53)
SMILES:C=CCN(C(=O)Nc1ccc(cc1)C(F)(F)F)C1CCN(CC1)CCC1(CCN(CC1)C(=O)c1cc(c(cc1Cl)F)S(=O)(=O)NC(C)(C)C)c1cccc(c1)F

Properties:
Formula:C40H47ClF5N5O4SAtoms:56
Molecular Weight:824.342Rotatable Bonds:16
H-bond Acceptors:9H-bond Donors:2
logP:9.8829
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:815279
CHEMBL1288879