In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2008 | 35 | 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) | 5.96 | 11.4 | -16.8 | 1 | 5 | 0 | 54 | 524.008 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.96 | 13.8 | -57.11 | 2 | 5 | 1 | 56 | 525.016 | 7 | ↓ |