(10Z)-tricyclo[10.2.2.24,7]octadeca-1(15),4,6,10,12(16),13,17-heptaen-9-ol
Formula:C18H18O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(10Z)-tricyclo[10.2.2.24,7]octadeca-1(15),4,6,10,12(16),13,17-heptaen-9-ol is a drug-like molecule.
| MolName | (10Z)-tricyclo[10.2.2.24,7]octadeca-1(15),4,6,10,12(16),13,17-heptaen-9-ol |
| MolecularFormula | C18H18O |
| Smiles | OC(Cc1ccc(CC2)cc1)/C=C\c1ccc2cc1 |
| InChI | InChI=1S/C18H18O/c19-18-12-11-16-5-3-14(4-6-16)1-2-15-7-9-17(13-18)10-8-15/h3-12,18-19H,1-2,13H2/b12-11-/t18-/m1/s1 |
| InChIK | QQLXWUUMESLKNJ-YUIUBULTSA-N |
| TotalMolweight | 250.34 |
| Molweight | 250.34 |
| MonoisotopicMass | 250.135765 |
| CLogP | 4.1665 |
| CLogS | -4.082 |
| H Acceptors | 1 |
| H Donors | 1 |
| TotalSurfaceArea | 206.15 |
| Relative PSA | 0.063546 |
| PolarSurfaceArea | 20.23 |
| Druglikeness | -1.2986 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47368 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| StereoCenters | 1 |
| Rings Closures | 3 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 4 |
| StereoCon | racemate |
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1 - (10Z)-tricyclo[10.2.2.24,7]octadeca-1(15),4,6,10,12(16),13,17-heptaen-9-ol | 2 - (10Z)-tricyclo[10.2.2.24,7]octadeca-1(15),4,6,10,12(16),13,17-heptaen-9-ol
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