In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 19 | No |
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) | 3.20 | 7.45 | -20.02 | 1 | 6 | 0 | 84 | 261.281 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 5.6 | -10.84 | 1 | 6 | 0 | 84 | 261.281 | 3 | ↓ |