In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 20 | 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) | 3.74 | 5.23 | -48.51 | 0 | 4 | -1 | 57 | 310.782 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 4.79 | -11.34 | 1 | 4 | 0 | 55 | 311.79 | 5 | ↓ |