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Ligand

NameCHEMBL213201
Molecular formulaC26H23ClN6O
IUPAC nameN-[8-chloro-6-(4-methylpiperazin-1-yl)benzo[b][1,4]benzodiazepin-11-yl]-4-cyanobenzamide
Molecular weight470.961
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.1
SynonymsN-[2-chloro-11-(4-methyl-piperazin-1-yl)-dibenzo[b,e][1,4]diazepin-5-yl]-4-cyano-benzamide
BDBM50190074
Inchi KeyAUKPHAAWNDZREH-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H23ClN6O/c1-31-12-14-32(15-13-31)25-21-16-20(27)10-11-23(21)33(24-5-3-2-4-22(24)29-25)30-26(34)19-8-6-18(17-28)7-9-19/h2-11,16H,12-15H2,1H3,(H,30,34)
PubChem CID44415743
ChEMBLCHEMBL213201
IUPHARN/A
BindingDB50190074
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14721D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
14720D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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