(3E)-3-amino-N-cyclohexyl-3-[(3-fluorophenyl)methoxyimino]propanamide
Formula:C16H22N3O2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3E)-3-amino-N-cyclohexyl-3-[(3-fluorophenyl)methoxyimino]propanamide is a drug-like molecule.
| MolName | (3E)-3-amino-N-cyclohexyl-3-[(3-fluorophenyl)methoxyimino]propanamide |
| MolecularFormula | C16H22N3O2F |
| Smiles | N/C(/CC(NC1CCCCC1)=O)=N/OCc1cccc(F)c1 |
| InChI | InChI=1S/C16H22FN3O2/c17-13-6-4-5-12(9-13)11-22-20-15(18)10-16(21)19-14-7-2-1-3-8-14/h4-6,9,14H,1-3,7-8,10-11H2,(H2,18,20)(H,19,21) |
| InChIK | XUBALQXHTKVURY-UHFFFAOYSA-N |
| TotalMolweight | 307.368 |
| Molweight | 307.368 |
| MonoisotopicMass | 307.169605 |
| CLogP | 2.3342 |
| CLogS | -3.862 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 245.63 |
| Relative PSA | 0.24948 |
| PolarSurfaceArea | 76.71 |
| Druglikeness | -2.908 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 9 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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