1-cyclohexyl-3-[(Z)-(2-fluorophenyl)methylideneamino]urea
Formula:C14H18N3OF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
1-cyclohexyl-3-[(Z)-(2-fluorophenyl)methylideneamino]urea is a drug-like molecule.
| MolName | 1-cyclohexyl-3-[(Z)-(2-fluorophenyl)methylideneamino]urea |
| MolecularFormula | C14H18N3OF |
| Smiles | O=C(NC1CCCCC1)N/N=C\c(cccc1)c1F |
| InChI | InChI=1S/C14H18FN3O/c15-13-9-5-4-6-11(13)10-16-18-14(19)17-12-7-2-1-3-8-12/h4-6,9-10,12H,1-3,7-8H2,(H2,17,18,19) |
| InChIK | YNYUIXAXYKCALF-UHFFFAOYSA-N |
| TotalMolweight | 263.315 |
| Molweight | 263.315 |
| MonoisotopicMass | 263.14339 |
| CLogP | 3.1433 |
| CLogS | -4.618 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 212.84 |
| Relative PSA | 0.22303 |
| PolarSurfaceArea | 53.49 |
| Druglikeness | -1.3417 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 6 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - 1-cyclohexyl-3-[(Z)-(2-fluorophenyl)methylideneamino]urea | 2 - 1-cyclohexyl-3-[(Z)-(2-fluorophenyl)methylideneamino]urea
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