(4Z,8E)-cyclododeca-4,8-diene-1,2-diol
Formula:C12H20O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(4Z,8E)-cyclododeca-4,8-diene-1,2-diol is a drug-like molecule.
| MolName | (4Z,8E)-cyclododeca-4,8-diene-1,2-diol |
| MolecularFormula | C12H20O2 |
| Smiles | OC(CCC/C=C/CC/C=C\C1)C1O |
| InChI | InChI=1S/C12H20O2/c13-11-9-7-5-3-1-2-4-6-8-10-12(11)14/h1,3,6,8,11-14H,2,4-5,7,9-10H2 |
| InChIK | JLFYUWDLQLQRLO-UHFFFAOYSA-N |
| TotalMolweight | 196.289 |
| Molweight | 196.289 |
| MonoisotopicMass | 196.14633 |
| CLogP | 2.9048 |
| CLogS | -2.516 |
| H Acceptors | 2 |
| H Donors | 2 |
| TotalSurfaceArea | 173.26 |
| Relative PSA | 0.15122 |
| PolarSurfaceArea | 40.46 |
| Druglikeness | -8.5945 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 2 |
| Electronegative Atoms | 2 |
| StereoCenters | 2 |
| Rings Closures | 1 |
| Sp3Atoms | 10 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - (4Z,8E)-cyclododeca-4,8-diene-1,2-diol | 2 - (4Z,8E)-cyclododeca-4,8-diene-1,2-diol
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off