In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 22 | 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) | 2.68 | 7.72 | -34.57 | 1 | 4 | -1 | 57 | 345.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 8.81 | -11.69 | 2 | 4 | 0 | 50 | 346.424 | 7 | ↓ |