(NZ)-N-(2-benzylsulfanylcyclooctylidene)hydroxylamine
Formula:C15H21NOS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-(2-benzylsulfanylcyclooctylidene)hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-(2-benzylsulfanylcyclooctylidene)hydroxylamine |
| MolecularFormula | C15H21NOS |
| Smiles | O/N=C(/CCCCCC1)\C1SCc1ccccc1 |
| InChI | InChI=1S/C15H21NOS/c17-16-14-10-6-1-2-7-11-15(14)18-12-13-8-4-3-5-9-13/h3-5,8-9,15,17H,1-2,6-7,10-12H2/b16-14-/t15-/m0/s1 |
| InChIK | PQLCLZANVLHLEE-RIBQPWQFSA-N |
| TotalMolweight | 263.404 |
| Molweight | 263.404 |
| MonoisotopicMass | 263.134384 |
| CLogP | 4.789 |
| CLogS | -4.599 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 215.39 |
| Relative PSA | 0.19546 |
| PolarSurfaceArea | 57.89 |
| Druglikeness | -3.5299 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.61111 |
| Fragments | 1 |
| Non HAtoms | 18 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 10 |
| Symmetricatoms | 2 |
| StereoCon | racemate |
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