[(Z)-naphthalen-2-ylmethylideneamino]urea
Formula:C12H11N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-naphthalen-2-ylmethylideneamino]urea is a drug-like molecule.
| MolName | [(Z)-naphthalen-2-ylmethylideneamino]urea |
| MolecularFormula | C12H11N3O |
| Smiles | NC(N/N=C\c1cc2ccccc2cc1)=O |
| InChI | InChI=1S/C12H11N3O/c13-12(16)15-14-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-8H,(H3,13,15,16) |
| InChIK | QPOJLFLDGNOWOZ-UHFFFAOYSA-N |
| TotalMolweight | 213.239 |
| Molweight | 213.239 |
| MonoisotopicMass | 213.090212 |
| CLogP | 2.3297 |
| CLogS | -4.42 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 170.35 |
| Relative PSA | 0.30103 |
| PolarSurfaceArea | 67.48 |
| Druglikeness | 4.2967 |
| 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 | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Amides | 1 |
| StereoCon |
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