N-[(Z)-[(2Z)-2-(phenylhydrazinylidene)ethylidene]amino]pyridine-4-carboxamide
Formula:C14H13N5O
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
N-[(Z)-[(2Z)-2-(phenylhydrazinylidene)ethylidene]amino]pyridine-4-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-[(2Z)-2-(phenylhydrazinylidene)ethylidene]amino]pyridine-4-carboxamide |
| MolecularFormula | C14H13N5O |
| Smiles | O=C(c1ccncc1)N/N=C\C=N/Nc1ccccc1 |
| InChI | InChI=1S/C14H13N5O/c20-14(12-6-8-15-9-7-12)19-17-11-10-16-18-13-4-2-1-3-5-13/h1-11,18H,(H,19,20) |
| InChIK | VQKZOKFQYSVURO-UHFFFAOYSA-N |
| TotalMolweight | 267.291 |
| Molweight | 267.291 |
| MonoisotopicMass | 267.11201 |
| CLogP | 2.555 |
| CLogS | -2.595 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 221.97 |
| Relative PSA | 0.31513 |
| PolarSurfaceArea | 78.74 |
| Druglikeness | 4.4687 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.75 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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