In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 19 | Yes |
Popular Name: 1-(6-aminopurin-9-yl)-3-(2-hydroxyethyl-methyl-amino)-propan-2-ol 1-(6-aminopurin-9-yl)-3-(2-hydro…
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) | -0.94 | 0.84 | -48.44 | 5 | 8 | 1 | 115 | 267.313 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.94 | 1.25 | -95.62 | 6 | 8 | 2 | 116 | 268.321 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.94 | -3.33 | -84.77 | 6 | 8 | 2 | 116 | 268.321 | 6 | ↓ |