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Ligand

NameCHEMBL68709
Molecular formulaC25H23N5O3
IUPAC name11-[2-(4-benzoylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight441.491
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP1.2
Synonyms11-[2-(4-Benzoyl-piperazin-1-yl)-acetyl]-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one
BDBM50012329
5,11-Dihydro-11-[[4-benzoyl-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Inchi KeyCBJZAKJGURGLPY-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H23N5O3/c31-22(17-28-13-15-29(16-14-28)25(33)18-7-2-1-3-8-18)30-21-11-5-4-9-19(21)24(32)27-20-10-6-12-26-23(20)30/h1-12H,13-17H2,(H,27,32)
PubChem CID15050938
ChEMBLCHEMBL68709
IUPHARN/A
BindingDB50012329
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
37952Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
37954Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
37955Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
37953Muscarinic acetylcholine receptor M4P08485Chrm4Rattus norvegicus (Rat)478

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