In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 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) | 1.38 | 4.96 | -45.25 | 2 | 5 | 1 | 49 | 272.413 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.38 | 7.16 | -126.5 | 3 | 5 | 2 | 51 | 273.421 | 7 | ↓ |