| MolName | 1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea |
| MolecularFormula | C25H17N5O |
| Smiles | O=C(Nc(cc1)cc2c1[nH]c1nc3ccccc3nc12)Nc1cc2ccccc2cc1 |
| InChI | InChI=1S/C25H17N5O/c31-25(26-17-10-9-15-5-1-2-6-16(15)13-17)27-18-11-12-20-19(14-18)23-24(29-20)30-22-8-4-3-7-21(22)28-23/h1-14H,(H,29,30)(H2,26,27,31) |
| InChIK | JCEZQMOMDTXYOL-UHFFFAOYSA-N |
| TotalMolweight | 403.444 |
| Molweight | 403.444 |
| MonoisotopicMass | 403.14331 |
| CLogP | 5.1947 |
| CLogS | -7.822 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 299.18 |
| Relative PSA | 0.24029 |
| PolarSurfaceArea | 82.7 |
| Druglikeness | 0.029297 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.58065 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 6 |
| Small Rings | 6 |
| Aromatic Rings | 6 |
| Aromatic Atoms | 27 |
| Amides | 2 |
| Aromatic Nitrogens | 3 |
| StereoCon |
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1 - 1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea | 2 - 1-(6H-indolo[3,2-b]quinoxalin-9-yl)-3-naphthalen-2-ylurea