In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 19 | 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) | 2.67 | 2.53 | -8.52 | 3 | 4 | 0 | 61 | 319.158 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 2.86 | -44.69 | 4 | 4 | 1 | 66 | 320.166 | 2 | ↓ |