In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 35 | 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) | 4.18 | 9.57 | -63.57 | 0 | 8 | -1 | 105 | 489.529 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 8.81 | -16.23 | 1 | 8 | 0 | 102 | 490.537 | 6 | ↓ |