In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 21 | Yes |
Popular Name: 2-[5-(2-amino-9H-purin-6-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-1-yl]ethanol 2-[5-(2-amino-9H-purin-6-yl)-4,6…
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) | -0.32 | 2.96 | -13.28 | 4 | 9 | 0 | 122 | 286.299 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | 3.4 | -36.66 | 5 | 9 | 1 | 123 | 287.307 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.