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Name | CHEMBL1808998 |
---|---|
Molecular formula | C25H26N4O3 |
IUPAC name | (6aR,9R)-9-N-(2-hydroxyethyl)-9-N-methyl-7-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7,9-dicarboxamide |
Molecular weight | 430.508 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 3 |
XlogP | 1.7 |
Synonyms | BDBM50349640 |
Inchi Key | YIHFFXWGJWZDBZ-VGOFRKELSA-N |
Inchi ID | InChI=1S/C25H26N4O3/c1-28(10-11-30)24(31)17-12-20-19-8-5-9-21-23(19)16(14-26-21)13-22(20)29(15-17)25(32)27-18-6-3-2-4-7-18/h2-9,12,14,17,22,26,30H,10-11,13,15H2,1H3,(H,27,32)/t17-,22-/m1/s1 |
PubChem CID | 56660099 |
ChEMBL | CHEMBL1808998 |
IUPHAR | N/A |
BindingDB | 50349640 |
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 |
---|---|---|---|---|---|
410826 | C-X-C chemokine receptor type 3 | P49682 | CXCR3 | Homo sapiens (Human) | 368 |
410827 | C-X-C chemokine receptor type 3 | O88410 | Cxcr3 | Mus musculus (Mouse) | 367 |
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