In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2011 | 25 | Yes |
Popular Name: 2-methyl-N-(2-pyridylmethyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidine-6-carboxamide 2-methyl-N-(2-pyridylmethyl)-4-p…
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) | 0.24 | 6.09 | -22.57 | 1 | 8 | 0 | 89 | 337.387 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.24 | 6.5 | -43.36 | 2 | 8 | 1 | 90 | 338.395 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.