In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 16 | Yes |
Popular Name: [2-(2,5-dimethylpyrazol-3-yl)sulfanyl-4-pyridyl]methanamine [2-(2,5-dimethylpyrazol-3-yl)sul…
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) | 1.26 | 3.38 | -56.41 | 3 | 4 | 1 | 58 | 235.336 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 2.99 | -7.85 | 2 | 4 | 0 | 57 | 234.328 | 3 | ↓ |