In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2009 | 22 | Yes |
Popular Name: (1-ethyl-3,6-dimethyl-pyrazolo[3,4-b]pyridin-4-yl)-(4-methylpiperazin-1-yl)methanone (1-ethyl-3,6-dimethyl-pyrazolo[3…
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) | 0.62 | 5.11 | -10.7 | 0 | 6 | 0 | 54 | 301.394 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 7.5 | -52.7 | 1 | 6 | 1 | 55 | 302.402 | 2 | ↓ |