In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | 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) | 0.94 | 4.78 | -27.35 | 4 | 6 | 1 | 85 | 291.375 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.94 | 4.35 | -7.02 | 3 | 6 | 0 | 84 | 290.367 | 2 | ↓ |