In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2009 | 37 | 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) | 5.93 | 14.01 | -10 | 1 | 4 | 0 | 45 | 515.698 | 12 | ↓ |
Lo Low (pH 4.5-6) | 5.93 | 16.02 | -50.02 | 2 | 4 | 1 | 46 | 516.706 | 12 | ↓ |