In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 32 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-[1-(2-fluorophenyl)-6-methyl-pyrazolo[3,4-b]pyridin-4-yl]methanone (4-benzylpiperazin-1-yl)-[1-(2-f…
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) | 3.02 | 11.29 | -16.1 | 0 | 6 | 0 | 54 | 429.499 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 13.5 | -56.15 | 1 | 6 | 1 | 55 | 430.507 | 4 | ↓ |