In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 12 | 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) | -4.97 | -0.67 | -122.72 | 2 | 7 | -2 | 130 | 175.096 | 4 | ↓ |
Lo Low (pH 4.5-6) | -4.97 | -2.42 | -51.39 | 3 | 7 | -1 | 127 | 176.104 | 4 | ↓ |