5-chloro-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
Formula:C17H13N4Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
5-chloro-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine is not a drug-like molecule.
| MolName | 5-chloro-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine |
| MolecularFormula | C17H13N4Cl |
| Smiles | Clc(cc1)cnc1N/N=C(/c1ccccc1)\c1ncccc1 |
| InChI | InChI=1S/C17H13ClN4/c18-14-9-10-16(20-12-14)21-22-17(13-6-2-1-3-7-13)15-8-4-5-11-19-15/h1-12H,(H,20,21) |
| InChIK | YHHFKWKMXWRVTJ-UHFFFAOYSA-N |
| TotalMolweight | 308.771 |
| Molweight | 308.771 |
| MonoisotopicMass | 308.082873 |
| CLogP | 5.0472 |
| CLogS | -4.62 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 240.15 |
| Relative PSA | 0.18701 |
| PolarSurfaceArea | 50.17 |
| Druglikeness | 1.2961 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon |
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