In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 20 | 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) | 2.98 | 7.8 | -49.48 | 1 | 4 | -1 | 69 | 278.372 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 5.82 | -13.16 | 2 | 4 | 0 | 66 | 279.38 | 6 | ↓ |