N-[(Z)-(1-aminopyridin-2-ylidene)amino]benzamide
Formula:C12H12N4O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(1-aminopyridin-2-ylidene)amino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-(1-aminopyridin-2-ylidene)amino]benzamide |
| MolecularFormula | C12H12N4O |
| Smiles | NN(C=CC=C1)/C1=N\NC(c1ccccc1)=O |
| InChI | InChI=1S/C12H12N4O/c13-16-9-5-4-8-11(16)14-15-12(17)10-6-2-1-3-7-10/h1-9H,13H2,(H,15,17) |
| InChIK | LYBLOHWZRDWHLN-UHFFFAOYSA-N |
| TotalMolweight | 228.254 |
| Molweight | 228.254 |
| MonoisotopicMass | 228.101111 |
| CLogP | -0.0637 |
| CLogS | -2.74 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 183.76 |
| Relative PSA | 0.29838 |
| PolarSurfaceArea | 70.72 |
| Druglikeness | 2.0045 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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