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Ligand

NameCHEMBL303678
Molecular formulaC20H21N5O3
IUPAC name11-[2-(4-acetylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight379.42
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP-0.4
Synonyms11-[2-(4-Acetyl-piperazin-1-yl)-acetyl]-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one
BDBM50012354
5,11-Dihydro-11-[[4-acetyl-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Inchi KeyBRGCUQPQKZURGP-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21N5O3/c1-14(26)24-11-9-23(10-12-24)13-18(27)25-17-7-3-2-5-15(17)20(28)22-16-6-4-8-21-19(16)25/h2-8H,9-13H2,1H3,(H,22,28)
PubChem CID15050937
ChEMBLCHEMBL303678
IUPHARN/A
BindingDB50012354
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
30960Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
30961Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
30959Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
30958Muscarinic acetylcholine receptor M4P08485Chrm4Rattus norvegicus (Rat)478

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