In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2009 | 27 | Yes |
Popular Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine N-[3-(4-benzylpiperazin-1-yl)pro…
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) | 1.66 | 9.25 | -51.92 | 2 | 7 | 1 | 63 | 366.493 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 9.21 | -46.93 | 2 | 7 | 1 | 63 | 366.493 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 6.87 | -11.44 | 1 | 7 | 0 | 62 | 365.485 | 7 | ↓ |