In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 20 | Yes |
Popular Name: N,1-dimethyl-N-(2-piperazin-1-ylethyl)pyrazolo[3,4-d]pyrimidin-4-amine N,1-dimethyl-N-(2-piperazin-1-yl…
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) | -0.36 | 4.26 | -45.59 | 2 | 7 | 1 | 67 | 276.368 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.36 | 2.91 | -9.59 | 1 | 7 | 0 | 62 | 275.36 | 4 | ↓ |