In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2010 | 16 | Yes |
Popular Name: 2-(4-chloro-6-methyl-pyrazolo[3,4-d]pyrimidin-1-yl)-N,N-dimethyl-ethanamine 2-(4-chloro-6-methyl-pyrazolo[3,…
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) | 1.01 | 6.05 | -38.44 | 1 | 5 | 1 | 48 | 240.718 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 3.59 | -5.65 | 0 | 5 | 0 | 47 | 239.71 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.