[(E)-[amino(phenyl)methylidene]amino] N-naphthalen-2-ylcarbamate
Formula:C18H15N3O2
Mutagenic:low
Tumorigenic:high
Reproductive Effective:none
[(E)-[amino(phenyl)methylidene]amino] N-naphthalen-2-ylcarbamate is a drug-like molecule.
| MolName | [(E)-[amino(phenyl)methylidene]amino] N-naphthalen-2-ylcarbamate |
| MolecularFormula | C18H15N3O2 |
| Smiles | N/C(/c1ccccc1)=N/OC(Nc1cc2ccccc2cc1)=O |
| InChI | InChI=1S/C18H15N3O2/c19-17(14-7-2-1-3-8-14)21-23-18(22)20-16-11-10-13-6-4-5-9-15(13)12-16/h1-12H,(H2,19,21)(H,20,22) |
| InChIK | VEXRRYIZONXZDH-UHFFFAOYSA-N |
| TotalMolweight | 305.336 |
| Molweight | 305.336 |
| MonoisotopicMass | 305.116427 |
| CLogP | 4.2604 |
| CLogS | -5.658 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 238.32 |
| Relative PSA | 0.25713 |
| PolarSurfaceArea | 76.71 |
| Druglikeness | -5.7284 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65217 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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