vicriviroc   Click here for help

GtoPdb Ligand ID: 807

Synonyms: SCH 417690 | SCH-417690 | SCH-D690 | SCH-DS
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 61.8
Molecular weight 533.3
XLogP 3.37
No. Lipinski's rules broken 0
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Canonical SMILES COCC(N1CCN(CC1C)C1(C)CCN(CC1)C(=O)c1c(C)ncnc1C)c1ccc(cc1)C(F)(F)F
Isomeric SMILES COC[C@H](N1CCN(C[C@@H]1C)C1(C)CCN(CC1)C(=O)c1c(C)ncnc1C)c1ccc(cc1)C(F)(F)F
InChI InChI=1S/C28H38F3N5O2/c1-19-16-35(14-15-36(19)24(17-38-5)22-6-8-23(9-7-22)28(29,30)31)27(4)10-12-34(13-11-27)26(37)25-20(2)32-18-33-21(25)3/h6-9,18-19,24H,10-17H2,1-5H3/t19-,24-/m0/s1
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
8647 vicriviroc
Synonyms Click here for help
SCH 417690 | SCH-417690 | SCH-D690 | SCH-DS
Database Links Click here for help
Specialist databases
GPCRdb Ligand vicriviroc
Other databases
BindingDB Ligand 50145685
CAS Registry No. 306296-47-9 (source: Scifinder)
ChEMBL Ligand CHEMBL82301
GtoPdb PubChem SID 135651306
PubChem CID 3009355
Search Google for chemical match using the InChIKey CNPVJJQCETWNEU-CYFREDJKSA-N
Search Google for chemicals with the same backbone CNPVJJQCETWNEU
Search PubMed clinical trials vicriviroc
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UniChem Compound Search for chemical match using the InChIKey CNPVJJQCETWNEU-CYFREDJKSA-N
UniChem Connectivity Search for chemical match using the InChIKey CNPVJJQCETWNEU-CYFREDJKSA-N
Wikipedia Vicriviroc