| MolName | 1-(2,3-dihydroindol-1-yl)-2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone |
| MolecularFormula | C18H14N3O2FS |
| Smiles | O=C(CSc1nnc(-c(cccc2)c2F)o1)N(CC1)c2c1cccc2 |
| InChI | InChI=1S/C18H14FN3O2S/c19-14-7-3-2-6-13(14)17-20-21-18(24-17)25-11-16(23)22-10-9-12-5-1-4-8-15(12)22/h1-8H,9-11H2 |
| InChIK | BZBQZCZKATXAJK-UHFFFAOYSA-N |
| TotalMolweight | 355.392 |
| Molweight | 355.392 |
| MonoisotopicMass | 355.079075 |
| CLogP | 3.5747 |
| CLogS | -5.807 |
| H Acceptors | 5 |
| TotalSurfaceArea | 259.66 |
| Relative PSA | 0.27008 |
| PolarSurfaceArea | 84.53 |
| Druglikeness | 3.0758 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 4 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - 1-(2,3-dihydroindol-1-yl)-2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone | 2 - 1-(2,3-dihydroindol-1-yl)-2-[[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone