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Ligand

NameCHEMBL3686825
Molecular formulaC26H30N4O4
IUPAC name2-[2-[4-[[(2S,6S)-2-amino-6-methylmorpholin-4-yl]methyl]-2-methylphenyl]-2-oxoethyl]-5-phenylmethoxypyridazin-3-one
Molecular weight462.55
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.0
SynonymsBDBM142191
US8933079, 5.10
Inchi KeyAMWRHENRCKUIKV-DFBJGRDBSA-N
Inchi IDInChI=1S/C26H30N4O4/c1-18-10-21(14-29-13-19(2)34-25(27)16-29)8-9-23(18)24(31)15-30-26(32)11-22(12-28-30)33-17-20-6-4-3-5-7-20/h3-12,19,25H,13-17,27H2,1-2H3/t19-,25-/m0/s1
PubChem CID91759572
ChEMBLCHEMBL3686825
IUPHARN/A
BindingDB142191
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
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GLASS IDNameUniProtGeneSpeciesLength
464011Melanin-concentrating hormone receptor 1Q99705MCHR1Homo sapiens (Human)422

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