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Name | CHEMBL443550 |
---|---|
Molecular formula | C25H21Cl2N3O2 |
IUPAC name | 3-(2,4-dichlorophenyl)-N-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]propanamide |
Molecular weight | 466.362 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 5.2 |
Synonyms | BDBM50061225 N-[[(3R)-1-Methyl-2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin]-3-yl]-2,4-dichlorobenzenepropanamide 3-(2,4-Dichloro-phenyl)-N-((R)-1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-propionamide SCHEMBL8611972 |
Inchi Key | AMCBGQBUTPEAOP-XMMPIXPASA-N |
Inchi ID | InChI=1S/C25H21Cl2N3O2/c1-30-21-10-6-5-9-19(21)23(17-7-3-2-4-8-17)29-24(25(30)32)28-22(31)14-12-16-11-13-18(26)15-20(16)27/h2-11,13,15,24H,12,14H2,1H3,(H,28,31)/t24-/m1/s1 |
PubChem CID | 11798410 |
ChEMBL | CHEMBL443550 |
IUPHAR | N/A |
BindingDB | 50061225 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
8734 | Gastrin/cholecystokinin type B receptor | P32239 | CCKBR | Homo sapiens (Human) | 447 |
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