[(9E)-9-hydroxyiminofluoren-4-yl]-piperidin-1-ylmethanone
Formula:C19H18N2O2
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
[(9E)-9-hydroxyiminofluoren-4-yl]-piperidin-1-ylmethanone is a drug-like molecule.
| MolName | [(9E)-9-hydroxyiminofluoren-4-yl]-piperidin-1-ylmethanone |
| MolecularFormula | C19H18N2O2 |
| Smiles | O/N=C1/c2cccc(C(N3CCCCC3)=O)c2-c2c1cccc2 |
| InChI | InChI=1S/C19H18N2O2/c22-19(21-11-4-1-5-12-21)16-10-6-9-15-17(16)13-7-2-3-8-14(13)18(15)20-23/h2-3,6-10,23H,1,4-5,11-12H2 |
| InChIK | MBWOTAXKUVDVNQ-UHFFFAOYSA-N |
| TotalMolweight | 306.364 |
| Molweight | 306.364 |
| MonoisotopicMass | 306.136828 |
| CLogP | 4.6356 |
| CLogS | -5.69 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 232.19 |
| Relative PSA | 0.17744 |
| PolarSurfaceArea | 52.9 |
| Druglikeness | 1.608 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47826 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 1 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - [(9E)-9-hydroxyiminofluoren-4-yl]-piperidin-1-ylmethanone | 2 - [(9E)-9-hydroxyiminofluoren-4-yl]-piperidin-1-ylmethanone
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off