N-[(E)-(2-cyclohexylcyclohexylidene)amino]-3-hydroxynaphthalene-2-carboxamide
Formula:C23H28N2O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(E)-(2-cyclohexylcyclohexylidene)amino]-3-hydroxynaphthalene-2-carboxamide is not a drug-like molecule.
| MolName | N-[(E)-(2-cyclohexylcyclohexylidene)amino]-3-hydroxynaphthalene-2-carboxamide |
| MolecularFormula | C23H28N2O2 |
| Smiles | Oc1cc2ccccc2cc1C(N/N=C(\CCCC1)/C1C1CCCCC1)=O |
| InChI | InChI=1S/C23H28N2O2/c26-22-15-18-11-5-4-10-17(18)14-20(22)23(27)25-24-21-13-7-6-12-19(21)16-8-2-1-3-9-16/h4-5,10-11,14-16,19,26H,1-3,6-9,12-13H2,(H,25,27)/t19-/m0/s1 |
| InChIK | UAHHGJUIUYPJOS-IBGZPJMESA-N |
| TotalMolweight | 364.487 |
| Molweight | 364.487 |
| MonoisotopicMass | 364.215078 |
| CLogP | 5.4144 |
| CLogS | -6.379 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 288.23 |
| Relative PSA | 0.17038 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | -0.83016 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.55556 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 12 |
| Symmetricatoms | 2 |
| StereoCon | racemate |
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1 - N-[(E)-(2-cyclohexylcyclohexylidene)amino]-3-hydroxynaphthalene-2-carboxamide | 2 - N-[(E)-(2-cyclohexylcyclohexylidene)amino]-3-hydroxynaphthalene-2-carboxamide
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