(NE)-N-[(4Z)-8-cyclohexylsulfanylcyclooct-4-en-1-ylidene]hydroxylamine
Formula:C14H23NOS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(4Z)-8-cyclohexylsulfanylcyclooct-4-en-1-ylidene]hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-[(4Z)-8-cyclohexylsulfanylcyclooct-4-en-1-ylidene]hydroxylamine |
| MolecularFormula | C14H23NOS |
| Smiles | O/N=C(\CC/C=C\CC1)/C1SC1CCCCC1 |
| InChI | InChI=1S/C14H23NOS/c16-15-13-10-6-1-2-7-11-14(13)17-12-8-4-3-5-9-12/h1-2,12,14,16H,3-11H2/b2-1?,15-13+/t14-/m0/s1 |
| InChIK | JNDFSKXZQKCPMO-YUMZSAIASA-N |
| TotalMolweight | 253.409 |
| Molweight | 253.409 |
| MonoisotopicMass | 253.150034 |
| CLogP | 4.6801 |
| CLogS | -4.114 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 208.65 |
| Relative PSA | 0.20177 |
| PolarSurfaceArea | 57.89 |
| Druglikeness | -7.7175 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.58824 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 1 |
| Sp3Atoms | 13 |
| Symmetricatoms | 2 |
| StereoCon | racemate |
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