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Ligand

NameCHEMBL1956258
Molecular formulaC21H25NO
IUPAC name3-[5-tert-butyl-2-(hydroxymethyl)-3-propan-2-ylphenyl]benzonitrile
Molecular weight307.437
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP5.2
SynonymsBDBM50366011
Inchi KeyXDIJLMUJOCIRMD-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25NO/c1-14(2)18-10-17(21(3,4)5)11-19(20(18)13-23)16-8-6-7-15(9-16)12-22/h6-11,14,23H,13H2,1-5H3
PubChem CID57395667
ChEMBLCHEMBL1956258
IUPHARN/A
BindingDB50366011
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
388979Vasoactive intestinal polypeptide receptor 1P30083Vipr1Rattus norvegicus (Rat)459

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