In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | 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) | 1.00 | 5.31 | -50.52 | 0 | 6 | -1 | 78 | 248.262 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 5.39 | -38.56 | 1 | 6 | 0 | 80 | 249.27 | 2 | ↓ |