N-[(Z)-benzylideneamino]-2-(1H-indol-3-yl)acetamide
Formula:C17H15N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-2-(1H-indol-3-yl)acetamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-2-(1H-indol-3-yl)acetamide |
| MolecularFormula | C17H15N3O |
| Smiles | O=C(Cc1c[nH]c2c1cccc2)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C17H15N3O/c21-17(20-19-11-13-6-2-1-3-7-13)10-14-12-18-16-9-5-4-8-15(14)16/h1-9,11-12,18H,10H2,(H,20,21) |
| InChIK | IIDRYIRGPKWBJV-UHFFFAOYSA-N |
| TotalMolweight | 277.326 |
| Molweight | 277.326 |
| MonoisotopicMass | 277.121512 |
| CLogP | 3.2391 |
| CLogS | -4.211 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 224.92 |
| Relative PSA | 0.2223 |
| PolarSurfaceArea | 57.25 |
| Druglikeness | 4.9614 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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