In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 12 | 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) | 0.58 | 3.18 | -72.9 | 1 | 4 | -1 | 77 | 166.156 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.58 | 2.02 | -49.34 | 1 | 4 | -1 | 73 | 166.156 | 3 | ↓ |