In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 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) | 1.64 | 5.22 | -5.08 | 1 | 3 | 0 | 38 | 165.24 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 5.65 | -28.37 | 2 | 3 | 1 | 39 | 166.248 | 3 | ↓ |