| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 20 | No |
Popular Name: 4-[(3S)-1-cyclopropylpyrrolidin-3-yl]-5-(4-pyridyl)-1,2,4-triazole-3-thiol 4-[(3S)-1-cyclopropylpyrrolidin-…
| 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) | 1.52 | 8.01 | -42.24 | 1 | 5 | 0 | 48 | 287.392 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 5.63 | -41.54 | 0 | 5 | -1 | 47 | 286.384 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.79 | 7.76 | -41.14 | 2 | 5 | 1 | 51 | 288.4 | 3 | ↓ |
