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Name | CHEMBL1809011 |
---|---|
Molecular formula | C27H28N4O3 |
IUPAC name | (6aR,9R)-9-(4-hydroxypiperidine-1-carbonyl)-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7-carboxamide |
Molecular weight | 456.546 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 2.2 |
Synonyms | BDBM50349652 |
Inchi Key | CAOVBFVVCXSCPJ-HOYKHHGWSA-N |
Inchi ID | InChI=1S/C27H28N4O3/c32-20-9-11-30(12-10-20)26(33)18-13-22-21-7-4-8-23-25(21)17(15-28-23)14-24(22)31(16-18)27(34)29-19-5-2-1-3-6-19/h1-8,13,15,18,20,24,28,32H,9-12,14,16H2,(H,29,34)/t18-,24-/m1/s1 |
PubChem CID | 56670448 |
ChEMBL | CHEMBL1809011 |
IUPHAR | N/A |
BindingDB | 50349652 |
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 |
---|---|---|---|---|---|
37400 | C-X-C chemokine receptor type 3 | P49682 | CXCR3 | Homo sapiens (Human) | 368 |
37401 | C-X-C chemokine receptor type 3 | O88410 | Cxcr3 | Mus musculus (Mouse) | 367 |
37402 | C-X-C chemokine receptor type 3 | Q9JII9 | Cxcr3 | Rattus norvegicus (Rat) | 367 |
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