In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 20 | 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) | 2.75 | 5.92 | -6.35 | 1 | 4 | 0 | 43 | 272.348 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 6.36 | -37.21 | 2 | 4 | 1 | 45 | 273.356 | 7 | ↓ |