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Ligand

NameCHEMBL327365
Molecular formulaC32H29N3O2S
IUPAC nameN-[4-(1,2,4,4a,5,11-hexahydro-[1,4]thiazino[3,4-c][1,4]benzodiazepine-6-carbonyl)phenyl]-2-phenylbenzamide
Molecular weight519.663
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.5
SynonymsL019922
BDBM50146292
Biphenyl-2-carboxylic acid [4-(3,4,11,11a-tetrahydro-1H,5H-2-thia-4a,10-diaza-dibenzo[a,d]cycloheptene-10-carbonyl)-phenyl]-amide
Inchi KeyBXOKIJAEZHPQKJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H29N3O2S/c36-31(29-12-6-5-11-28(29)23-8-2-1-3-9-23)33-26-16-14-24(15-17-26)32(37)35-21-27-22-38-19-18-34(27)20-25-10-4-7-13-30(25)35/h1-17,27H,18-22H2,(H,33,36)
PubChem CID9849525
ChEMBLCHEMBL327365
IUPHARN/A
BindingDB50146292
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35272Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418
35273Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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