In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 23 | Yes |
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) | 3.39 | 7.85 | -14.33 | 1 | 4 | 0 | 47 | 310.397 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 8.65 | -29.14 | 2 | 4 | 1 | 49 | 311.405 | 7 | ↓ |