In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2011 | 22 | 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) | -0.07 | 3.87 | -51.87 | 2 | 6 | 1 | 57 | 313.466 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 5.93 | -118.27 | 3 | 6 | 2 | 58 | 314.474 | 7 | ↓ |