(10E)-10-phenylmethoxyiminophenanthren-9-one
Formula:C21H15NO2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(10E)-10-phenylmethoxyiminophenanthren-9-one is a drug-like molecule.
| MolName | (10E)-10-phenylmethoxyiminophenanthren-9-one |
| MolecularFormula | C21H15NO2 |
| Smiles | O=C(c(cccc1)c1-c1c2cccc1)/C2=N/OCc1ccccc1 |
| InChI | InChI=1S/C21H15NO2/c23-21-19-13-7-5-11-17(19)16-10-4-6-12-18(16)20(21)22-24-14-15-8-2-1-3-9-15/h1-13H,14H2 |
| InChIK | GLBJTCRATSBCPJ-UHFFFAOYSA-N |
| TotalMolweight | 313.355 |
| Molweight | 313.355 |
| MonoisotopicMass | 313.110279 |
| CLogP | 4.9328 |
| CLogS | -6.318 |
| H Acceptors | 3 |
| TotalSurfaceArea | 243.76 |
| Relative PSA | 0.14174 |
| PolarSurfaceArea | 38.66 |
| Druglikeness | 2.0378 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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