In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 33 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-[6-(4-methoxyphenyl)-1-methyl-pyrazolo[3,4-b]pyridin-4-yl]methanone (4-benzylpiperazin-1-yl)-[6-(4-m…
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) | 2.93 | 9.67 | -11.82 | 0 | 7 | 0 | 63 | 441.535 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 11.86 | -54.98 | 1 | 7 | 1 | 65 | 442.543 | 5 | ↓ |