| General Property |
| Molceule ID (DB) | EGIN0002853 |
| Inhibitor Class | Dithiobis-indole |
| Molecule Name in Refrence Article | 10t compound |
| IUPAC Name | 6-hydroxy-2-({6-hydroxy-1-methyl-3-[(phenylamino)methyl]-1H-indol-2-yl}disulfanyl)-1-methyl-N-phenyl-1H-indole-3-carboxamide |
| Formula | C32H28N4O3S2 |
| Mass | 580.72 |
| Exact Mass | 580.1602822 |
| Composition | C (66.18%), H (4.86%), N (9.65%), O (8.27%), S (11.04%) |
| Atom Count | 69 |
| PI | 6.46 |
| Smiles | Cn1c(SSc2c(CNc3ccccc3)c3ccc(cc3n2C)O)c(C(=O)Nc2ccccc2)c2ccc(cc12)O |
| InChI | 1S/C32H28N4O3S2/c1-35-27-17-22(37)13-15-24(27)26(19-33-20-9-5-3-6-10-20)31(35)40-41-32-29(30(39)34-2
1-11-7-4-8-12-21)25-16-14-23(38)18-28(25)36(32)2/h3-18,33,37-38H,19H2,1-2H3,(H,34,39) |
| InChIKey | GJCBITNSFGVJRM-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 | 8027985 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | SRC | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL293913 |
