| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2009 | 22 | Yes |
Popular Name: (2R)-2-[[1-(3-chlorophenyl)-4-oxo-5H-pyrazolo[5,4-d]pyrimidin-6-yl]sulfanyl]propanenitrile (2R)-2-[[1-(3-chlorophenyl)-4-ox…
| 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) | 3.75 | 7.1 | -38.59 | 0 | 6 | -1 | 90 | 330.78 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.30 | 8.21 | -14.33 | 1 | 6 | 0 | 87 | 331.788 | 3 | ↓ |
