| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 17th, 2011 | 27 | No |
Popular Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-5-(2-thienyl)-1,3,4-oxadiazole-2-thione 3-[[4-(4-nitrophenyl)piperazin-1…
| 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) | 3.01 | 6.55 | -15.03 | 0 | 8 | 0 | 83 | 403.489 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.01 | 8.96 | -56.24 | 1 | 8 | 1 | 84 | 404.497 | 5 | ↓ |
