In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 20 | Yes |
Popular Name: 9-[3-hydroxy-5-(hydroxymethyl)-4-methylamino-tetrahydrofuran-2-yl]-3H-purin-6-one 9-[3-hydroxy-5-(hydroxymethyl)-4…
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) | -2.36 | -2.87 | -65.3 | 5 | 9 | 1 | 130 | 282.28 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.90 | -6.18 | -53.62 | 3 | 9 | -1 | 128 | 280.264 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.36 | -4.13 | -20.97 | 4 | 9 | 0 | 125 | 281.272 | 3 | ↓ |