(NZ)-N-[2-(4-fluoroanilino)cyclododecylidene]hydroxylamine
Formula:C18H27N2OF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[2-(4-fluoroanilino)cyclododecylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[2-(4-fluoroanilino)cyclododecylidene]hydroxylamine |
| MolecularFormula | C18H27N2OF |
| Smiles | O/N=C(/CCCCCCCCCC1)\C1Nc(cc1)ccc1F |
| InChI | InChI=1S/C18H27FN2O/c19-15-11-13-16(14-12-15)20-17-9-7-5-3-1-2-4-6-8-10-18(17)21-22/h11-14,17,20,22H,1-10H2/b21-18-/t17-/m0/s1 |
| InChIK | PXVQJCSHJMWCCB-FQMKLWGBSA-N |
| TotalMolweight | 306.423 |
| Molweight | 306.423 |
| MonoisotopicMass | 306.210741 |
| CLogP | 5.7626 |
| CLogS | -5.211 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 256.99 |
| Relative PSA | 0.14036 |
| PolarSurfaceArea | 44.62 |
| Druglikeness | -6.1175 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 12 |
| Symmetricatoms | 2 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon | racemate |
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1 - (NZ)-N-[2-(4-fluoroanilino)cyclododecylidene]hydroxylamine | 2 - (NZ)-N-[2-(4-fluoroanilino)cyclododecylidene]hydroxylamine
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