| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2009 | 17 | Yes |
Popular Name: 3-isobutyl-6-[(2S)-pyrrolidin-2-yl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 3-isobutyl-6-[(2S)-pyrrolidin-2-…
| 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) | 1.45 | 5.98 | -53.53 | 2 | 5 | 1 | 60 | 252.367 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.62 | -9.54 | 1 | 5 | 0 | 55 | 251.359 | 3 | ↓ |
