(NE)-N-(2,3,3a,4,5,6,7,7a-octahydroinden-1-ylidene)hydroxylamine
Formula:C9H15NO
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(2,3,3a,4,5,6,7,7a-octahydroinden-1-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(2,3,3a,4,5,6,7,7a-octahydroinden-1-ylidene)hydroxylamine |
| MolecularFormula | C9H15NO |
| Smiles | O/N=C(\CC1)/C2C1CCCC2 |
| InChI | InChI=1S/C9H15NO/c11-10-9-6-5-7-3-1-2-4-8(7)9/h7-8,11H,1-6H2 |
| InChIK | XVCRTDFJYAUMOC-UHFFFAOYSA-N |
| TotalMolweight | 153.224 |
| Molweight | 153.224 |
| MonoisotopicMass | 153.115364 |
| CLogP | 2.5524 |
| CLogS | -2.853 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 123.38 |
| Relative PSA | 0.19947 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -5.9852 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 11 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| StereoCenters | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3Atoms | 9 |
| StereoCon | unknown chirality |
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1 - (NE)-N-(2,3,3a,4,5,6,7,7a-octahydroinden-1-ylidene)hydroxylamine | 2 - (NE)-N-(2,3,3a,4,5,6,7,7a-octahydroinden-1-ylidene)hydroxylamine
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