In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 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) | 1.27 | 3.37 | -44.23 | 4 | 2 | 1 | 40 | 258.183 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.27 | 4.6 | -122.64 | 5 | 2 | 2 | 44 | 259.191 | 5 | ↓ |