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Ligand

NameCHEMBL97335
Molecular formulaC24H21Cl2N3
IUPAC name1-N,3-N-bis[2-(3-chlorophenyl)ethyl]isoindole-1,3-diimine
Molecular weight422.353
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP6.1
SynonymsBDBM50105666
N,N'-Bis(3-chlorophenethyl)isoindoline-1,3-diimine
1,3-Bis-[(Z)-2-(3-chloro-phenyl)-ethylimino]-2,3-dihydro-1H-isoindole
Inchi KeyICHVWCGMMGNCCF-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H21Cl2N3/c25-19-7-3-5-17(15-19)11-13-27-23-21-9-1-2-10-22(21)24(29-23)28-14-12-18-6-4-8-20(26)16-18/h1-10,15-16H,11-14H2,(H,27,28,29)
PubChem CID136110897
ChEMBLCHEMBL97335
IUPHARN/A
BindingDB50105666
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
129783C3a anaphylatoxin chemotactic receptorQ16581C3AR1Homo sapiens (Human)482

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