In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 15 | Yes |
Popular Name: 2-(4-chloropyrazolo[3,4-d]pyrimidin-1-yl)-N,N-dimethyl-ethanamine 2-(4-chloropyrazolo[3,4-d]pyrimi…
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) | 0.92 | 6.08 | -38.51 | 1 | 5 | 1 | 48 | 226.691 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 3.61 | -5.59 | 0 | 5 | 0 | 47 | 225.683 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.