In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2008 | 32 | 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) | 5.46 | 10.47 | -51.96 | 0 | 6 | -1 | 88 | 445.52 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.00 | 13.14 | -13.78 | 1 | 6 | 0 | 85 | 446.528 | 6 | ↓ |