(NZ)-N-[(8aR,10aR)-2,3,4,5,6,7,8,8a,9,10a-decahydroxanthen-1-ylidene]hydroxylamine
Formula:C13H19NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(8aR,10aR)-2,3,4,5,6,7,8,8a,9,10a-decahydroxanthen-1-ylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(8aR,10aR)-2,3,4,5,6,7,8,8a,9,10a-decahydroxanthen-1-ylidene]hydroxylamine |
| MolecularFormula | C13H19NO2 |
| Smiles | O/N=C(/CCC1)\C2=C1O[C@H](CCCC1)[C@H]1C2 |
| InChI | InChI=1S/C13H19NO2/c15-14-11-5-3-7-13-10(11)8-9-4-1-2-6-12(9)16-13/h9,12,15H,1-8H2/t9-,12+/m0/s1 |
| InChIK | VYOLIGMUJMNWIA-JOYOIKCWSA-N |
| TotalMolweight | 221.299 |
| Molweight | 221.299 |
| MonoisotopicMass | 221.141579 |
| CLogP | 3.0184 |
| CLogS | -3.682 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 170.32 |
| Relative PSA | 0.20321 |
| PolarSurfaceArea | 41.82 |
| Druglikeness | -5.3259 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| StereoCenters | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Sp3Atoms | 12 |
| StereoCon | this enantiomer |
Click to Load Molecule:
1 - (NZ)-N-[(8aR,10aR)-2,3,4,5,6,7,8,8a,9,10a-decahydroxanthen-1-ylidene]hydroxylamine | 2 - (NZ)-N-[(8aR,10aR)-2,3,4,5,6,7,8,8a,9,10a-decahydroxanthen-1-ylidene]hydroxylamine
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