In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 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) | 1.78 | 5.3 | -12 | 1 | 4 | 0 | 55 | 249.273 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.78 | 5.57 | -34.64 | 2 | 4 | 1 | 56 | 250.281 | 2 | ↓ |