In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2007 | 16 | Yes |
None
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) | 3.60 | 6.12 | -5.32 | 3 | 3 | 0 | 55 | 235.718 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.60 | 6.11 | -30.3 | 4 | 3 | 1 | 56 | 236.726 | 3 | ↓ |