In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2008 | 25 | No |
Popular Name: 3-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-5-(2-thienyl)-1,3,4-oxadiazole-2-thione 3-[[4-(2-fluorophenyl)piperazin-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.17 | 6.61 | -9.86 | 0 | 5 | 0 | 37 | 376.482 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.17 | 9.1 | -36.66 | 1 | 5 | 1 | 39 | 377.49 | 4 | ↓ |