N-[(Z)-pyridin-2-ylmethylideneamino]quinolin-8-amine
Formula:C15H12N4
Mutagenic:low
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-pyridin-2-ylmethylideneamino]quinolin-8-amine is a drug-like molecule.
| MolName | N-[(Z)-pyridin-2-ylmethylideneamino]quinolin-8-amine |
| MolecularFormula | C15H12N4 |
| Smiles | C(c1ncccc1)=N\Nc1c2ncccc2ccc1 |
| InChI | InChI=1S/C15H12N4/c1-2-9-16-13(7-1)11-18-19-14-8-3-5-12-6-4-10-17-15(12)14/h1-11,19H |
| InChIK | OWNBHZAKTGCIQZ-UHFFFAOYSA-N |
| TotalMolweight | 248.288 |
| Molweight | 248.288 |
| MonoisotopicMass | 248.106196 |
| CLogP | 4.21 |
| CLogS | -3.084 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 201.36 |
| Relative PSA | 0.22303 |
| PolarSurfaceArea | 50.17 |
| Druglikeness | 2.4225 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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