In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 17 | No |
Popular Name: 6-chloro-1-methyl-4-piperazin-1-yl-pyrazolo[3,4-d]pyrimidine 6-chloro-1-methyl-4-piperazin-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) | 0.61 | 4.18 | -49.1 | 2 | 6 | 1 | 63 | 253.717 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 2.87 | -6.41 | 1 | 6 | 0 | 59 | 252.709 | 1 | ↓ |