N-[(Z)-pyridin-4-ylmethylideneamino]quinolin-2-amine
Formula:C15H12N4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-pyridin-4-ylmethylideneamino]quinolin-2-amine is a drug-like molecule.
| MolName | N-[(Z)-pyridin-4-ylmethylideneamino]quinolin-2-amine |
| MolecularFormula | C15H12N4 |
| Smiles | C(c1ccncc1)=N\Nc1nc2ccccc2cc1 |
| InChI | InChI=1S/C15H12N4/c1-2-4-14-13(3-1)5-6-15(18-14)19-17-11-12-7-9-16-10-8-12/h1-11H,(H,18,19) |
| InChIK | XFJYFGPKADPPTR-UHFFFAOYSA-N |
| TotalMolweight | 248.288 |
| Molweight | 248.288 |
| MonoisotopicMass | 248.106196 |
| CLogP | 4.5074 |
| CLogS | -3.585 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 201.36 |
| Relative PSA | 0.22303 |
| PolarSurfaceArea | 50.17 |
| Druglikeness | 2.4225 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.68421 |
| 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 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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