In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2011 | 18 | No |
Popular Name: 9-[(1R,4R)-3-fluoro-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one 9-[(1R,4R)-3-fluoro-4-(hydroxyme…
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) | -0.26 | 3.1 | -21.47 | 2 | 6 | 0 | 84 | 250.233 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.20 | 1.01 | -57.67 | 1 | 6 | -1 | 87 | 249.225 | 2 | ↓ |