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Name | CHEMBL1779415 |
---|---|
Molecular formula | C29H27ClN4O7S |
IUPAC name | (3R)-5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxypyridin-3-yl)-3-[2-(1,3-oxazol-2-yl)pyrrolidin-1-yl]indol-2-one |
Molecular weight | 611.066 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 0 |
XlogP | 4.0 |
Synonyms | BDBM50345137 (+/-)-(3R)-5-chloro-1-(2,4-dimethoxyphenylsulfonyl)-3-(2-methoxypyridin-3-yl)-3-(2-(oxazol-2-yl)pyrrolidin-1-yl)indolin-2-one |
Inchi Key | ASOTVOFICYBESK-IZCXSWDTSA-N |
Inchi ID | InChI=1S/C29H27ClN4O7S/c1-38-19-9-11-25(24(17-19)39-2)42(36,37)34-22-10-8-18(30)16-21(22)29(28(34)35,20-6-4-12-31-26(20)40-3)33-14-5-7-23(33)27-32-13-15-41-27/h4,6,8-13,15-17,23H,5,7,14H2,1-3H3/t23?,29-/m0/s1 |
PubChem CID | 54583496 |
ChEMBL | CHEMBL1779415 |
IUPHAR | N/A |
BindingDB | 50345137 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
13377 | Vasopressin V1b receptor | P47901 | AVPR1B | Homo sapiens (Human) | 424 |
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