In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2008 | 26 | 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) | -2.77 | -1.82 | -57.83 | 7 | 11 | 0 | 187 | 384.418 | 7 | ↓ |
Lo Low (pH 4.5-6) | -2.77 | -1.55 | -81.56 | 8 | 11 | 1 | 188 | 385.426 | 7 | ↓ |
Lo Low (pH 4.5-6) | -2.77 | -5.93 | -79.74 | 8 | 11 | 1 | 188 | 385.426 | 7 | ↓ |