In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 17 | 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) | 3.00 | 8.17 | -28.65 | 1 | 1 | 1 | 14 | 226.274 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 7.26 | -4.66 | 0 | 1 | 0 | 12 | 225.266 | 1 | ↓ |