In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 12 | 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) | -1.28 | 1.89 | -44.54 | 3 | 4 | 0 | 81 | 166.18 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.28 | 2.44 | -62.41 | 4 | 4 | 1 | 82 | 167.188 | 3 | ↓ |