In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2010 | 15 | 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) | 2.43 | 5.24 | -27.37 | 2 | 3 | 1 | 38 | 209.313 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 4.87 | -6.48 | 1 | 3 | 0 | 36 | 208.305 | 6 | ↓ |