In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 18 | 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) | 2.27 | 2.15 | -13.03 | 4 | 4 | 0 | 75 | 262.696 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 2.82 | -44.5 | 3 | 4 | -1 | 78 | 261.688 | 2 | ↓ |