In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 31 | 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) | 4.62 | 9.47 | -9.55 | 0 | 5 | 0 | 56 | 453.325 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.62 | 9.93 | -41.85 | 1 | 5 | 1 | 57 | 454.333 | 3 | ↓ |