General Property |
Molceule ID (DB) | EGIN0004488 |
Inhibitor Class | Pyrido-pyrimidine |
Molecule Name in Refrence Article | 4c |
IUPAC Name | 4-({4-amino-6-cyanopyrido[2,3-d]pyrimidin-7-yl}amino)benzene-1-sulfonamide |
Formula | C14H11N7O2S |
Mass | 341.348 |
Exact Mass | 341.0694933 |
Composition | C (49.26%), H (3.25%), N (28.72%), O (9.37%), S (9.39%) |
Atom Count | 35 |
PI | 7.52 |
Smiles | c1(ncnc2c1cc(c(n2)Nc1ccc(cc1)S(=O)(=O)N)C#N)N |
InChI | 1S/C14H11N7O2S/c15-6-8-5-11-12(16)18-7-19-14(11)21-13(8)20-9-1-3-10(4-2-9)24(17,22)23/h1-5,7H,(H2,17
,22,23)(H3,16,18,19,20,21) |
InChIKey | IXGYMRBBOWQFDT-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0004488.png) | Structure Backbone | ![](./frame/f_EGIN0004488.png) |
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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 | 22000924 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | CDK4/D | CDK2/A | ALL |
Pub Chem Link |
56649645
|
Drug Bank Link | - |
ChemSpider Link | 28484578 |
ChEMBL Link | CHEMBL1910270 |