In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 38 | Yes |
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) | 6.06 | 16.03 | -17.52 | 1 | 6 | 0 | 67 | 529.084 | 8 | ↓ |
Lo Low (pH 4.5-6) | 6.06 | 16.63 | -41.47 | 2 | 6 | 1 | 68 | 530.092 | 8 | ↓ |