N-[(Z)-3-anilino-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
Formula:C24H19N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-3-anilino-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.
| MolName | N-[(Z)-3-anilino-1-(1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide |
| MolecularFormula | C24H19N3O2 |
| Smiles | O=C(/C(/NC(c1ccccc1)=O)=C/c1c[nH]c2c1cccc2)Nc1ccccc1 |
| InChI | InChI=1S/C24H19N3O2/c28-23(17-9-3-1-4-10-17)27-22(24(29)26-19-11-5-2-6-12-19)15-18-16-25-21-14-8-7-13-20(18)21/h1-16,25H,(H,26,29)(H,27,28) |
| InChIK | CILWXVNZDLIQMV-UHFFFAOYSA-N |
| TotalMolweight | 381.434 |
| Molweight | 381.434 |
| MonoisotopicMass | 381.147727 |
| CLogP | 4.4632 |
| CLogS | -5.398 |
| H Acceptors | 5 |
| H Donors | 3 |
| TotalSurfaceArea | 300.08 |
| Relative PSA | 0.20991 |
| PolarSurfaceArea | 73.99 |
| Druglikeness | 3.1825 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44828 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 21 |
| Symmetricatoms | 4 |
| Amides | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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