In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 14 | 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) | 0.81 | 3.05 | -49.54 | 3 | 3 | 1 | 54 | 192.238 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.81 | 2.65 | -8.2 | 2 | 3 | 0 | 52 | 191.23 | 2 | ↓ |