In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 21 | No |
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) | 2.28 | 11.6 | -17.44 | 0 | 3 | 0 | 37 | 281.355 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 11.67 | -49.96 | 0 | 3 | -1 | 43 | 280.347 | 5 | ↓ |