In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 38 | No |
None
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) | 6.29 | 13.38 | -13.93 | 0 | 6 | 0 | 57 | 529.036 | 6 | ↓ |
Lo Low (pH 4.5-6) | 6.29 | 16.25 | -57.77 | 1 | 6 | 1 | 58 | 530.044 | 6 | ↓ |