In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2008 | 18 | Yes |
Popular Name: 9-[(2R,4S,5S)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-purin-2-one 9-[(2R,4S,5S)-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) | -1.66 | -4 | -15.85 | 3 | 8 | 0 | 113 | 252.23 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.21 | -5.92 | -53.58 | 2 | 8 | -1 | 116 | 251.222 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.