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Ligand

NameCHEMBL80230
Molecular formulaC24H23N3O3
IUPAC name7-[4-[(4-hydroxy-3-phenylphenyl)methyl]piperazin-1-yl]-3H-1,3-benzoxazol-2-one
Molecular weight401.466
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50103826
7-[4-(6-Hydroxy-3-biphenylylmethyl)piperazino]-2,3-dihydrobenzoxazole-2-one
7-[4-(6-Hydroxy-biphenyl-3-ylmethyl)-piperazin-1-yl]-3H-benzooxazol-2-one
Inchi KeyAIPVMDNBQLPSHM-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23N3O3/c28-22-10-9-17(15-19(22)18-5-2-1-3-6-18)16-26-11-13-27(14-12-26)21-8-4-7-20-23(21)30-24(29)25-20/h1-10,15,28H,11-14,16H2,(H,25,29)
PubChem CID44315406
ChEMBLCHEMBL80230
IUPHARN/A
BindingDB50103826
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
64365-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
6435D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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