In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 16 | 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) | 1.52 | 3.38 | -37.99 | 2 | 3 | 1 | 29 | 225.356 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.52 | 5.63 | -106.82 | 3 | 3 | 2 | 30 | 226.364 | 3 | ↓ |