(NZ)-N-[(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)methylidene]hydroxylamine
Formula:C15H12N4O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)methylidene]hydroxylamine |
| MolecularFormula | C15H12N4O |
| Smiles | O/N=C\c1cn(-c2ccccc2)nc1-c1ccncc1 |
| InChI | InChI=1S/C15H12N4O/c20-17-10-13-11-19(14-4-2-1-3-5-14)18-15(13)12-6-8-16-9-7-12/h1-11,20H |
| InChIK | MSHXVYBUFJIABD-UHFFFAOYSA-N |
| TotalMolweight | 264.287 |
| Molweight | 264.287 |
| MonoisotopicMass | 264.101111 |
| CLogP | 2.1324 |
| CLogS | -3.033 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 210.61 |
| Relative PSA | 0.25364 |
| PolarSurfaceArea | 63.3 |
| Druglikeness | 2.9148 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.55 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 3 |
| StereoCon |
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