In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2010 | 15 | 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) | -0.82 | 0.24 | -10.61 | 2 | 5 | 0 | 71 | 207.233 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.82 | 0.69 | -42.89 | 3 | 5 | 1 | 72 | 208.241 | 4 | ↓ |