2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]-1H-pyrimidin-6-one
Formula:C10H9N5O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]-1H-pyrimidin-6-one is a drug-like molecule.
| MolName | 2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]-1H-pyrimidin-6-one |
| MolecularFormula | C10H9N5O |
| Smiles | O=C1NC(N/N=C\c2cnccc2)=NC=C1 |
| InChI | InChI=1S/C10H9N5O/c16-9-3-5-12-10(14-9)15-13-7-8-2-1-4-11-6-8/h1-7H,(H2,12,14,15,16) |
| InChIK | JCFRABLGGDNUSI-UHFFFAOYSA-N |
| TotalMolweight | 215.215 |
| Molweight | 215.215 |
| MonoisotopicMass | 215.08071 |
| CLogP | -0.0788 |
| CLogS | -2.613 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 173.42 |
| Relative PSA | 0.40336 |
| PolarSurfaceArea | 78.74 |
| Druglikeness | 2.4512 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| BasicNitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]-1H-pyrimidin-6-one | 2 - 2-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]-1H-pyrimidin-6-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off