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Ligand

NameCHEMBL1086467
Molecular formulaC26H23ClN4O
IUPAC name[(3R)-4-[4-(4-chlorophenyl)phthalazin-1-yl]-3-methylpiperazin-1-yl]-phenylmethanone
Molecular weight442.947
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.2
SynonymsBDBM50320341
SCHEMBL1089469
(R)-(4-(4-(4-chlorophenyl)phthalazin-1-yl)-3-methylpiperazin-1-yl)(phenyl)methanone
Inchi KeyCHNHCRBXHMOZTQ-GOSISDBHSA-N
Inchi IDInChI=1S/C26H23ClN4O/c1-18-17-30(26(32)20-7-3-2-4-8-20)15-16-31(18)25-23-10-6-5-9-22(23)24(28-29-25)19-11-13-21(27)14-12-19/h2-14,18H,15-17H2,1H3/t18-/m1/s1
PubChem CID46891199
ChEMBLCHEMBL1086467
IUPHARN/A
BindingDB50320341
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
42144Smoothened homologQ99835SMOHomo sapiens (Human)787

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