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Drug Details

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Name:CHEMBL1288880
PubChem ID:52944587
Pathway:-
InChI:InChI=1S/C41H49ClF5N5O4S/c1-5-18-52(38(54)48-27-28-9-11-29(12-10-28)41(45,46)47)32-13-19-50(20-14-32)21-15-40(30-7-6-8-31(43)24-30)16-22-51(23-17-40)37(53)33-25-36(35(44)26-34(33)42)57(55,56)49-39(2,3)4/h5-12,24-26,32,49H,1,13-23,27H2,2-4H3,(H,48,54)
SMILES:C=CCN(C(=O)NCc1ccc(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:C41H49ClF5N5O4SAtoms:57
Molecular Weight:838.369Rotatable Bonds:17
H-bond Acceptors:9H-bond Donors:2
logP:9.8785
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:815280
CHEMBL1288880