N-[(Z)-benzylideneamino]-1H-benzimidazol-2-amine
Formula:C14H12N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-1H-benzimidazol-2-amine is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-1H-benzimidazol-2-amine |
| MolecularFormula | C14H12N4 |
| Smiles | C(c1ccccc1)=N\Nc1nc(cccc2)c2[nH]1 |
| InChI | InChI=1S/C14H12N4/c1-2-6-11(7-3-1)10-15-18-14-16-12-8-4-5-9-13(12)17-14/h1-10H,(H2,16,17,18) |
| InChIK | OEVCAFXADCPZLF-UHFFFAOYSA-N |
| TotalMolweight | 236.277 |
| Molweight | 236.277 |
| MonoisotopicMass | 236.106196 |
| CLogP | 4.81 |
| CLogS | -3.631 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 192.17 |
| Relative PSA | 0.24941 |
| PolarSurfaceArea | 53.07 |
| Druglikeness | 3.2659 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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