In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 19 | 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) | 2.74 | 6.17 | -33.4 | 2 | 3 | 1 | 39 | 281.445 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.09 | -5.46 | 1 | 3 | 0 | 34 | 280.437 | 4 | ↓ |