N-(4-fluorophenyl)-2-[3-[(Z)-hydroxyiminomethyl]indol-1-yl]acetamide
Formula:C17H14N3O2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(4-fluorophenyl)-2-[3-[(Z)-hydroxyiminomethyl]indol-1-yl]acetamide is a drug-like molecule.
| MolName | N-(4-fluorophenyl)-2-[3-[(Z)-hydroxyiminomethyl]indol-1-yl]acetamide |
| MolecularFormula | C17H14N3O2F |
| Smiles | O/N=C\c1cn(CC(Nc(cc2)ccc2F)=O)c2c1cccc2 |
| InChI | InChI=1S/C17H14FN3O2/c18-13-5-7-14(8-6-13)20-17(22)11-21-10-12(9-19-23)15-3-1-2-4-16(15)21/h1-10,23H,11H2,(H,20,22) |
| InChIK | GMDROYIJKVNCHF-UHFFFAOYSA-N |
| TotalMolweight | 311.315 |
| Molweight | 311.315 |
| MonoisotopicMass | 311.107005 |
| CLogP | 3.1294 |
| CLogS | -3.796 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 237.25 |
| Relative PSA | 0.23595 |
| PolarSurfaceArea | 66.62 |
| Druglikeness | 2.4317 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6087 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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