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Drug Details

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Name:CHEMBL1288914
PubChem ID:52944616
Pathway:-
InChI:InChI=1S/C42H52ClF2N5O6S/c1-6-19-50(40(53)46-28-29-10-12-30(13-11-29)39(52)56-5)33-14-20-48(21-15-33)22-16-42(31-8-7-9-32(44)25-31)17-23-49(24-18-42)38(51)34-26-37(36(45)27-35(34)43)57(54,55)47-41(2,3)4/h6-13,25-27,33,47H,1,14-24,28H2,2-5H3,(H,46,53)
SMILES:C=CCN(C(=O)NCc1ccc(cc1)C(=O)OC)C1CCN(CC1)CCC1(CCN(CC1)C(=O)c1cc(c(cc1Cl)F)S(=O)(=O)NC(C)(C)C)c1cccc(c1)F

Properties:
Formula:C42H52ClF2N5O6SAtoms:57
Molecular Weight:828.407Rotatable Bonds:18
H-bond Acceptors:11H-bond Donors:2
logP:8.6463
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:815315
CHEMBL1288914