In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 26 | Yes |
Popular Name: [4-(2-pyridyl)piperazin-1-yl]-(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)methanone [4-(2-pyridyl)piperazin-1-yl]-(1…
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) | 1.04 | 8.51 | -44.05 | 1 | 7 | 1 | 68 | 351.434 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 8.19 | -14.39 | 0 | 7 | 0 | 67 | 350.426 | 2 | ↓ |