In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | 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) | 2.83 | 5.63 | -41.27 | 2 | 4 | 1 | 38 | 295.447 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.83 | 6.67 | -35.65 | 2 | 4 | 1 | 35 | 295.447 | 10 | ↓ |