(NZ)-N-[2-(benzenesulfonyl)cyclododecylidene]hydroxylamine
Formula:C18H27NO3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[2-(benzenesulfonyl)cyclododecylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[2-(benzenesulfonyl)cyclododecylidene]hydroxylamine |
| MolecularFormula | C18H27NO3S |
| Smiles | O/N=C(/CCCCCCCCCC1)\C1S(c1ccccc1)(=O)=O |
| InChI | InChI=1S/C18H27NO3S/c20-19-17-14-10-5-3-1-2-4-6-11-15-18(17)23(21,22)16-12-8-7-9-13-16/h7-9,12-13,18,20H,1-6,10-11,14-15H2/b19-17-/t18-/m0/s1 |
| InChIK | VUVNVXNGNZOYAH-VZCCSQPZSA-N |
| TotalMolweight | 337.482 |
| Molweight | 337.482 |
| MonoisotopicMass | 337.171164 |
| CLogP | 5.1546 |
| CLogS | -5.004 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 267.76 |
| Relative PSA | 0.19865 |
| PolarSurfaceArea | 75.11 |
| Druglikeness | -12.79 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 13 |
| Symmetricatoms | 3 |
| StereoCon | racemate |
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