| BioID | bio3573 |
|---|
| Name | LENIOLISIB |
|---|
| ChEMBL ID | CHEMBL3643413 |
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| Molecular Formula | C21H25F3N6O2 |
|---|
| Molecular Weight | 450.47 |
|---|
| Molecular Weight (Monoisotopic) | 450.1991 |
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| Type | Small molecule |
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| Max Phase | Phase 4 |
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| Target ID | Tar18 |
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| Target Name | Serine/threonine-protein kinase cot (COT) |
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| Synonyms | CDZ-173 FREE BASE|CDZ-173-NX|CDZ173 FREE BASE|CDZ173-NX|LENIOLISIB |
|---|
| Smiles | CCC(=O)N1CC[C@H](Nc2ncnc3c2CN(c2cnc(OC)c(C(F)(F)F)c2)CC3)C1 |
|---|
| Inchi | InChI=1S/C21H25F3N6O2/c1-3-18(31)30-6-4-13(10-30)28-19-15-11-29(7-5-17(15)26-12-27-19)14-8-16(21(22,23)24)20(32-2)25-9-14/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,26,27,28)/t13-/m0/s1 |
|---|
| Inchi Key | MWKYMZXCGYXLPL-ZDUSSCGKSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 126.0 |
|---|
| Bioactivities | 300.0 |
|---|
| Np Likeness Score | -1.57 |
|---|
| Records Key | ['CDZ173; 3h', 'LENIOLISIB', 'BDBM118299', 'EUB0000877a', 'EUB0000877b', 'LENIOLISIB', 'EUB0000877a', 'EUB0000877a', 'Fig 1, Cpd 9; CDZ173', 'EUB0000877a', 'EUB0000877a'] |
|---|
| Records Name | ['Leniolisib', 'LENIOLISIB', 'US8653092, 67', 'leniolisib', 'leniolisib', 'LENIOLISIB', 'leniolisib', 'leniolisib', '(S)-1-(3-(6-(6-methoxy-5-(trifluoromethyl)pyridin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-ylamino)pyrrolidin-1-yl)propan-1-one', 'leniolisib', 'leniolisib'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
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