In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 19 | No |
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) | 4.39 | 7.29 | -8.72 | 1 | 2 | 0 | 33 | 247.297 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.39 | 7.65 | -33.42 | 2 | 2 | 1 | 34 | 248.305 | 2 | ↓ |