In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 22 | No |
None
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) | 1.46 | 8.54 | -9.75 | 0 | 6 | 0 | 79 | 297.314 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.46 | 8.88 | -45.45 | 1 | 6 | 1 | 80 | 298.322 | 5 | ↓ |