[(Z)-[phenyl(pyridin-2-yl)methylidene]amino] N-cyclohexylcarbamate
Formula:C19H21N3O2
Mutagenic:low
Tumorigenic:low
Reproductive Effective:none
[(Z)-[phenyl(pyridin-2-yl)methylidene]amino] N-cyclohexylcarbamate is a drug-like molecule.
| MolName | [(Z)-[phenyl(pyridin-2-yl)methylidene]amino] N-cyclohexylcarbamate |
| MolecularFormula | C19H21N3O2 |
| Smiles | O=C(NC1CCCCC1)O/N=C(/c1ccccc1)\c1ncccc1 |
| InChI | InChI=1S/C19H21N3O2/c23-19(21-16-11-5-2-6-12-16)24-22-18(15-9-3-1-4-10-15)17-13-7-8-14-20-17/h1,3-4,7-10,13-14,16H,2,5-6,11-12H2,(H,21,23) |
| InChIK | CQYIYCWXGLMKBR-UHFFFAOYSA-N |
| TotalMolweight | 323.395 |
| Molweight | 323.395 |
| MonoisotopicMass | 323.163377 |
| CLogP | 4.0088 |
| CLogS | -5.359 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 261.76 |
| Relative PSA | 0.21768 |
| PolarSurfaceArea | 63.58 |
| Druglikeness | -14.615 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 7 |
| Symmetricatoms | 4 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - [(Z)-[phenyl(pyridin-2-yl)methylidene]amino] N-cyclohexylcarbamate | 2 - [(Z)-[phenyl(pyridin-2-yl)methylidene]amino] N-cyclohexylcarbamate
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