In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 18 | No |
Popular Name: 9-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrothiophen-2-yl]-3H-purin-6-one 9-[(2S,4S,5R)-4-hydroxy-5-(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) | -1.32 | 0.01 | -20.64 | 3 | 7 | 0 | 104 | 268.298 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.86 | -2.05 | -53.96 | 2 | 7 | -1 | 107 | 267.29 | 2 | ↓ |