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Name | AC1NDOC8 |
---|---|
Molecular formula | C18H16ClN3O3 |
IUPAC name | N-(3-chloro-2-methylphenyl)-4-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)butanamide |
Molecular weight | 357.794 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 2.3 |
Synonyms | SMR000307865 HMS2709F04 N-(3-chloro-2-methylphenyl)-4-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)butanamide CHEMBL1490398 SR-01000119353 [ Show all ] |
Inchi Key | GOZFEGLJABQWIK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H16ClN3O3/c1-11-13(19)6-2-7-14(11)21-15(23)8-4-10-22-17(24)12-5-3-9-20-16(12)18(22)25/h2-3,5-7,9H,4,8,10H2,1H3,(H,21,23) |
PubChem CID | 4604410 |
ChEMBL | CHEMBL1490398 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
101686 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
101685 | Relaxin receptor 2 | Q8WXD0 | RXFP2 | Homo sapiens (Human) | 754 |
101687 | Vasopressin V1b receptor | P47901 | AVPR1B | Homo sapiens (Human) | 424 |
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