In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2010 | 37 | 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) | 6.15 | 10.6 | -50.83 | 0 | 7 | -1 | 93 | 497.571 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.69 | 13.03 | -12.9 | 1 | 7 | 0 | 90 | 498.579 | 8 | ↓ |