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Ligand

NameCHEMBL215374
Molecular formulaC29H25ClN4O4S2
IUPAC name3-[4-(benzenesulfonyl)-2-[(dimethylamino)methyl]-2,3-dihydro-1,4-benzoxazin-6-yl]-6-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4-one
Molecular weight593.113
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP5.3
SynonymsBDBM50199232
6-(4-chlorophenyl)-3-[2-[(dimethylamino)methyl]-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]thieno[3,2-d]pyrimidin-4(3H)-one
Inchi KeyAADSFGMHGXEQDC-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H25ClN4O4S2/c1-32(2)16-22-17-34(40(36,37)23-6-4-3-5-7-23)25-14-21(12-13-26(25)38-22)33-18-31-24-15-27(39-28(24)29(33)35)19-8-10-20(30)11-9-19/h3-15,18,22H,16-17H2,1-2H3
PubChem CID11994018
ChEMBLCHEMBL215374
IUPHARN/A
BindingDB50199232
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
117Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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