In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 2nd, 2011 | 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) | 3.25 | 7.06 | -38.82 | 3 | 3 | 1 | 37 | 297.422 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 6.05 | -38.36 | 3 | 3 | 1 | 40 | 297.422 | 5 | ↓ |