In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 23 | Yes |
Popular Name: 1-methyl-6-[[(2R)-2-phenylpyrrolidin-1-yl]methyl]-5H-pyrazolo[3,4-d]pyrimidin-4-one 1-methyl-6-[[(2R)-2-phenylpyrrol…
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) | 1.43 | 5.9 | -9.92 | 1 | 6 | 0 | 67 | 309.373 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 8.16 | -47.22 | 2 | 6 | 1 | 68 | 310.381 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.