(3Z)-3-undec-10-enylideneoxolan-2-one
Formula:C15H24O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-undec-10-enylideneoxolan-2-one is a drug-like molecule.
| MolName | (3Z)-3-undec-10-enylideneoxolan-2-one |
| MolecularFormula | C15H24O2 |
| Smiles | C=CCCCCCCCC/C=C(/CCO1)\C1=O |
| InChI | InChI=1S/C15H24O2/c1-2-3-4-5-6-7-8-9-10-11-14-12-13-17-15(14)16/h2,11H,1,3-10,12-13H2 |
| InChIK | IXYXUFDFWKKEQL-UHFFFAOYSA-N |
| TotalMolweight | 236.354 |
| Molweight | 236.354 |
| MonoisotopicMass | 236.17763 |
| CLogP | 4.5147 |
| CLogS | -3.508 |
| H Acceptors | 2 |
| TotalSurfaceArea | 214.6 |
| Relative PSA | 0.10736 |
| PolarSurfaceArea | 26.3 |
| Druglikeness | -12.963 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.82353 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bond | 9 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 11 |
| StereoCon |
Click to Load Molecule:
1 - (3Z)-3-undec-10-enylideneoxolan-2-one | 2 - (3Z)-3-undec-10-enylideneoxolan-2-one
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off