5-N-phenylpyridine-2,5-diamine
Formula:C11H11N3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
5-N-phenylpyridine-2,5-diamine is a drug-like molecule.
| MolName | 5-N-phenylpyridine-2,5-diamine |
| MolecularFormula | C11H11N3 |
| Smiles | Nc(cc1)ncc1Nc1ccccc1 |
| InChI | InChI=1S/C11H11N3/c12-11-7-6-10(8-13-11)14-9-4-2-1-3-5-9/h1-8,14H,(H2,12,13) |
| InChIK | RZBFVVRYQHWXAU-UHFFFAOYSA-N |
| TotalMolweight | 185.229 |
| Molweight | 185.229 |
| MonoisotopicMass | 185.095297 |
| CLogP | 1.8632 |
| CLogS | -3 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 151.76 |
| Relative PSA | 0.24842 |
| PolarSurfaceArea | 50.94 |
| Druglikeness | -0.9353 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| Amines | 1 |
| Aromatic Amines | 1 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - 5-N-phenylpyridine-2,5-diamine | 2 - 5-N-phenylpyridine-2,5-diamine
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