(E)-14-cyclopent-2-en-1-yltetradec-7-enenitrile
Formula:C19H31N
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-14-cyclopent-2-en-1-yltetradec-7-enenitrile is not a drug-like molecule.
| MolName | (E)-14-cyclopent-2-en-1-yltetradec-7-enenitrile |
| MolecularFormula | C19H31N |
| Smiles | N#CCCCCC/C=C/CCCCCCC1C=CCC1 |
| InChI | InChI=1S/C19H31N/c20-18-14-10-8-6-4-2-1-3-5-7-9-11-15-19-16-12-13-17-19/h1-2,12,16,19H,3-11,13-15,17H2/t19-/m1/s1 |
| InChIK | KKGBFUMXMGNBTE-LJQANCHMSA-N |
| TotalMolweight | 273.462 |
| Molweight | 273.462 |
| MonoisotopicMass | 273.245649 |
| CLogP | 6.6045 |
| CLogS | -5.242 |
| H Acceptors | 1 |
| TotalSurfaceArea | 266.09 |
| Relative PSA | 0.05096 |
| PolarSurfaceArea | 23.79 |
| Druglikeness | -24.563 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.9 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| StereoCenters | 1 |
| Rotatable Bond | 12 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 14 |
| StereoCon | racemate |
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