In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 43 | No |
Popular Name: [(2S,3S,4R,5R)-5-(6,8-diaminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2S,3S,4R,5R)-5-(6,8-diaminopur…
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) | -2.17 | -4.52 | -74.79 | 12 | 22 | -1 | 349 | 625.476 | 8 | ↓ |
Lo Low (pH 4.5-6) | -2.17 | -4.04 | -86.37 | 13 | 22 | 0 | 351 | 626.484 | 8 | ↓ |
Lo Low (pH 4.5-6) | -2.17 | -4.05 | -72.35 | 13 | 22 | 0 | 351 | 626.484 | 8 | ↓ |
Lo Low (pH 4.5-6) | -2.17 | -3.58 | -91.55 | 14 | 22 | 1 | 352 | 627.492 | 8 | ↓ |