In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 17 | 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) | 2.47 | 6.9 | -15.48 | 1 | 3 | 0 | 42 | 230.242 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 6.67 | -32.71 | 2 | 3 | 1 | 43 | 231.25 | 2 | ↓ |