(3Z)-3-[(2,4-dichlorophenyl)methoxyimino]-1-(furan-2-yl)propan-1-one
Formula:C14H11NO3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3Z)-3-[(2,4-dichlorophenyl)methoxyimino]-1-(furan-2-yl)propan-1-one is a drug-like molecule.
| MolName | (3Z)-3-[(2,4-dichlorophenyl)methoxyimino]-1-(furan-2-yl)propan-1-one |
| MolecularFormula | C14H11NO3Cl2 |
| Smiles | O=C(C/C=N\OCc(ccc(Cl)c1)c1Cl)c1ccco1 |
| InChI | InChI=1S/C14H11Cl2NO3/c15-11-4-3-10(12(16)8-11)9-20-17-6-5-13(18)14-2-1-7-19-14/h1-4,6-8H,5,9H2 |
| InChIK | PMGWXUCGTIWBRO-UHFFFAOYSA-N |
| TotalMolweight | 312.151 |
| Molweight | 312.151 |
| MonoisotopicMass | 311.011598 |
| CLogP | 3.4897 |
| CLogS | -5.134 |
| H Acceptors | 4 |
| TotalSurfaceArea | 233.58 |
| Relative PSA | 0.20832 |
| PolarSurfaceArea | 51.8 |
| Druglikeness | 1.6821 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 3 |
| StereoCon |
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