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Ligand

NameCHEMBL600480
Molecular formulaC29H22Cl5N7O
IUPAC name[5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazol-3-yl]-[4-(2,3-dichlorophenyl)piperazin-1-yl]methanone
Molecular weight661.793
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP7.8
SynonymsBDBM50310026
(4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-1H-pyrazol-3-yl)(4-(2,3-dichlorophenyl)piperazin-1-yl)methanone
Inchi KeyARIZXJMCKDVHLG-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H22Cl5N7O/c30-19-6-4-18(5-7-19)28-21(15-40-17-35-16-36-40)27(37-41(28)24-9-8-20(31)14-23(24)33)29(42)39-12-10-38(11-13-39)25-3-1-2-22(32)26(25)34/h1-9,14,16-17H,10-13,15H2
PubChem CID46231017
ChEMBLCHEMBL600480
IUPHARN/A
BindingDB50310026
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
12511Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473

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