6-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-2-one
Formula:C11H10N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:low
6-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-2-one is a drug-like molecule.
| MolName | 6-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-1H-pyrimidin-2-one |
| MolecularFormula | C11H10N4O2 |
| Smiles | Oc1cccc(/C=N\NC(N2)=CC=NC2=O)c1 |
| InChI | InChI=1S/C11H10N4O2/c16-9-3-1-2-8(6-9)7-13-15-10-4-5-12-11(17)14-10/h1-7,16H,(H2,12,14,15,17) |
| InChIK | DRGZRZKQHJCYPT-UHFFFAOYSA-N |
| TotalMolweight | 230.226 |
| Molweight | 230.226 |
| MonoisotopicMass | 230.080376 |
| CLogP | 1.5423 |
| CLogS | -4.336 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 181.01 |
| Relative PSA | 0.39821 |
| PolarSurfaceArea | 86.08 |
| Druglikeness | 2.9812 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | low |
| Nasty Functions | polar activated DB; imine/hydrazone of aldehyde |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Amides | 1 |
| BasicNitrogens | 1 |
| StereoCon |
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