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Ligand

NameCHEMBL469790
Molecular formulaC22H19ClN4O3S
IUPAC name6-(4-chlorophenyl)-3-[4-[(3R)-3-hydroxypyrrolidin-1-yl]-3-methoxyphenyl]thieno[3,2-d]triazin-4-one
Molecular weight454.929
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.0
SynonymsSCHEMBL4884625
BDBM50278542
(R)-6-(4-chlorophenyl)-3-(4-(3-hydroxypyrrolidin-1-yl)-3-methoxyphenyl)thieno[3,2-d][1,2,3]triazin-4(3H)-one
Inchi KeyAEMKVXCCHGLFJH-MRXNPFEDSA-N
Inchi IDInChI=1S/C22H19ClN4O3S/c1-30-19-10-15(6-7-18(19)26-9-8-16(28)12-26)27-22(29)21-17(24-25-27)11-20(31-21)13-2-4-14(23)5-3-13/h2-7,10-11,16,28H,8-9,12H2,1H3/t16-/m1/s1
PubChem CID12002494
ChEMBLCHEMBL469790
IUPHARN/A
BindingDB50278542
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3638Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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