General Property |
Molceule ID (DB) | EGIN0002435 |
Inhibitor Class | Pyrimidine |
Molecule Name in Refrence Article | 1s compound |
IUPAC Name | (2S)-2-({5,6-diphenylfuro[2,3-d]pyrimidin-4-yl}amino)-2-phenylethan-1-ol |
Formula | C26H21N3O2 |
Mass | 407.4638 |
Exact Mass | 407.1633769 |
Composition | C (76.64%), H (5.19%), N (10.31%), O (7.85%) |
Atom Count | 52 |
PI | 8.38 |
Smiles | n1cnc(c2c1oc(c2c1ccccc1)c1ccccc1)N[C@@H](c1ccccc1)CO |
InChI | 1S/C26H21N3O2/c30-16-21(18-10-4-1-5-11-18)29-25-23-22(19-12-6-2-7-13-19)24(20-14-8-3-9-15-20)31-26(2
3)28-17-27-25/h1-15,17,21,30H,16H2,(H,27,28,29)/t21-/m1/s1 |
InChIKey | CCGBAJCQZPJWCS-OAQYLSRUSA-N |
2D Structure | ![](./image/EGIN0002435.png) | Structure Backbone | ![](./frame/f_EGIN0002435.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 | 20550212 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
46855200
|
Drug Bank Link | - |
ChemSpider Link | 25037945 |
ChEMBL Link | CHEMBL1172781 |