| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 29th, 2006 | 26 | No |
Popular Name: 3-[(benzyl-ethyl-amino)methyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole-2-thione 3-[(benzyl-ethyl-amino)methyl]-5…
| 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) | 3.39 | 10.28 | -46.13 | 1 | 7 | 1 | 81 | 371.442 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.39 | 7.9 | -13.45 | 0 | 7 | 0 | 80 | 370.434 | 7 | ↓ |
