| General Property |
| Molceule ID (DB) | EGIN0003583 |
| Inhibitor Class | Pyrido-pyrimidine |
| Molecule Name in Refrence Article | 6e compound |
| IUPAC Name | 3-tert-butyl-1-(2-{[3-(4-methylpiperazin-1-yl)propyl]amino}-6-(2,3,5,6-tetramethylphenyl)pyrido[2,3-d]pyrimidin-7-yl)urea |
| Formula | C30H44N8O |
| Mass | 532.7234 |
| Exact Mass | 532.3638081 |
| Composition | C (67.64%), H (8.33%), N (21.03%), O (3%) |
| Atom Count | 83 |
| PI | 9.98 |
| Smiles | c1(c(c2c(c(cc(c2C)C)C)C)cc2c(n1)nc(nc2)NCCCN1CCN(CC1)C)NC(=O)NC(C)(C)C |
| InChI | 1S/C30H44N8O/c1-19-16-20(2)22(4)25(21(19)3)24-17-23-18-32-28(31-10-9-11-38-14-12-37(8)13-15-38)34-26
(23)33-27(24)35-29(39)36-30(5,6)7/h16-18H,9-15H2,1-8H3,(H3,31,32,33,34,35,36,39) |
| InChIKey | XTUXOBJKZJZVKD-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
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| View Structure in Jmol | Click to view 3 d structure Download Mol File |
| Drug Like Property | Druglikeliness |
| Symmetry & Geometry | Symmetry And Geometrical Information |
| Activity & Binding | Activity against isoform and covalant binding information |
| Topological Properties | Descriptors |
| Reference | 9240345 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | InsRT | PDGFr | FGFr | c-Src | ALL |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 8777720 |
| ChEMBL Link | CHEMBL75188 |
