(E)-3-(furan-2-yl)-N-(6H-indolo[3,2-b]quinoxalin-9-yl)prop-2-enamide
Formula:C21H14N4O2
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
(E)-3-(furan-2-yl)-N-(6H-indolo[3,2-b]quinoxalin-9-yl)prop-2-enamide is a drug-like molecule.
| MolName | (E)-3-(furan-2-yl)-N-(6H-indolo[3,2-b]quinoxalin-9-yl)prop-2-enamide |
| MolecularFormula | C21H14N4O2 |
| Smiles | O=C(/C=C/c1ccco1)Nc(cc1)cc2c1[nH]c1nc3ccccc3nc12 |
| InChI | InChI=1S/C21H14N4O2/c26-19(10-8-14-4-3-11-27-14)22-13-7-9-16-15(12-13)20-21(24-16)25-18-6-2-1-5-17(18)23-20/h1-12H,(H,22,26)(H,24,25) |
| InChIK | MOQAMWWXAVPJIC-UHFFFAOYSA-N |
| TotalMolweight | 354.368 |
| Molweight | 354.368 |
| MonoisotopicMass | 354.111676 |
| CLogP | 3.5243 |
| CLogS | -5.752 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 269.31 |
| Relative PSA | 0.27678 |
| PolarSurfaceArea | 83.81 |
| Druglikeness | -0.27639 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59259 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 22 |
| Amides | 1 |
| Aromatic Nitrogens | 3 |
| StereoCon |
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