In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 16 | 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) | 0.81 | 5.45 | -12.91 | 0 | 4 | 0 | 57 | 217.272 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.81 | 5.91 | -37.73 | 1 | 4 | 1 | 58 | 218.28 | 4 | ↓ |