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Name | CHEMBL515607 |
---|---|
Molecular formula | C28H36N4O4 |
IUPAC name | (2S,4R)-4-methoxy-2-N,2-N-dimethyl-1-N-[[2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]methyl]pyrrolidine-1,2-dicarboxamide |
Molecular weight | 492.62 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.8 |
Synonyms | BDBM50246608 SCHEMBL4195589 (4R)-4-Methoxy-1-(2-methyl-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)benzylcarbamoyl)-L-proline-N,N-dimethylamide |
Inchi Key | AWOLMGJLKPNBDY-NOZRDPDXSA-N |
Inchi ID | InChI=1S/C28H36N4O4/c1-19-15-21(26(33)31-14-8-7-10-20-9-5-6-11-24(20)31)12-13-22(19)17-29-28(35)32-18-23(36-4)16-25(32)27(34)30(2)3/h5-6,9,11-13,15,23,25H,7-8,10,14,16-18H2,1-4H3,(H,29,35)/t23-,25+/m1/s1 |
PubChem CID | 10206789 |
ChEMBL | CHEMBL515607 |
IUPHAR | N/A |
BindingDB | 50246608 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
16217 | Vasopressin V2 receptor | P30518 | AVPR2 | Homo sapiens (Human) | 371 |
16218 | Vasopressin V2 receptor | Q00788 | Avpr2 | Rattus norvegicus (Rat) | 371 |
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