In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2010 | 38 | 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) | -5.05 | 9.41 | -187.12 | 2 | 16 | -3 | 255 | 539.474 | 19 | ↓ |
Lo Low (pH 4.5-6) | -5.05 | 12.71 | -191.19 | 2 | 16 | -3 | 259 | 539.474 | 19 | ↓ |