In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 22 | 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) | 2.92 | 8.51 | -11.42 | 0 | 4 | 0 | 46 | 292.338 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 8.97 | -40.79 | 1 | 4 | 1 | 48 | 293.346 | 4 | ↓ |