(NZ)-N-(3-benzylsulfanyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
Formula:C14H17NOS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-(3-benzylsulfanyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-(3-benzylsulfanyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine |
| MolecularFormula | C14H17NOS |
| Smiles | O/N=C(/C1CC2CC1)\C2SCc1ccccc1 |
| InChI | InChI=1S/C14H17NOS/c16-15-13-11-6-7-12(8-11)14(13)17-9-10-4-2-1-3-5-10/h1-5,11-12,14,16H,6-9H2 |
| InChIK | ZIRBAGSCXHQBQU-UHFFFAOYSA-N |
| TotalMolweight | 247.361 |
| Molweight | 247.361 |
| MonoisotopicMass | 247.103084 |
| CLogP | 3.5575 |
| CLogS | -4.195 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 185.61 |
| Relative PSA | 0.22682 |
| PolarSurfaceArea | 57.89 |
| Druglikeness | 0.20925 |
| 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 | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 4 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 9 |
| Symmetricatoms | 2 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - (NZ)-N-(3-benzylsulfanyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine | 2 - (NZ)-N-(3-benzylsulfanyl-2-bicyclo[2.2.1]heptanylidene)hydroxylamine
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