| PDB CCD ID: | TEQ |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C21 H19 F N6 |
| InChI: | InChI=1S/C21H19FN6/c1-12-13(5-3-9-24-12)19-10-18(27-21-16(22)11-25-28(19)21)14-4-2-6-17-15(14)7-8-20(23)26-17/h2-9,11,18-19,27H,10H2,1H3,(H2,23,26)/t18-,19+/m0/s1 |
| InChIKey: | WSRZNMRSHUJOED-RBUKOAKNSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | Cc1ncccc1[C@H]2C[C@H](Nc3n2ncc3F)c4cccc5nc(N)ccc45 | | OpenEye OEToolkits 2.0.7 | Cc1c(cccn1)[C@H]2C[C@H](Nc3n2ncc3F)c4cccc5c4ccc(n5)N | | OpenEye OEToolkits 2.0.7 | Cc1c(cccn1)C2CC(Nc3n2ncc3F)c4cccc5c4ccc(n5)N | | CACTVS 3.385 | Cc1ncccc1[CH]2C[CH](Nc3n2ncc3F)c4cccc5nc(N)ccc45 |
|
| Name: | 5-[(5S,7R)-3-fluoranyl-7-(2-methylpyridin-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-5-yl]quinolin-2-amine;
5-[(5~{S},7~{R})-3-fluoranyl-7-(2-methylpyridin-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-5-yl]quinolin-2-amine |
| ChEMBL: | CHEMBL5178494 |
umich.edu