Drug Details

Name:

CHEMBL1288917

PubChem ID:

Pathway:

InChI:

InChI=1S/C41H48ClF5N4O4S/c1-5-18-51(37(52)24-28-9-11-29(12-10-28)41(45,46)47)32-13-19-49(20-14-32)21-15-40(30-7-6-8-31(43)25-30)16-22-50(23-17-40)38(53)33-26-36(35(44)27-34(33)42)56(54,55)48-39(2,3)4/h5-12,25-27,32,48H,1,13-24H2,2-4H3

SMILES:

C=CCN(C(=O)Cc1ccc(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:	C41H48ClF5N4O4S	Atoms:	56
Molecular Weight:	823.354	Rotatable Bonds:	16
H-bond Acceptors:	8	H-bond Donors:	1
logP:	9.3471

Targets:

Name	Uniprot ID	Source	References	Interaction
C-C chemokine receptor type 5	CCR5_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:815318

CHEMBL1288917

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