In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 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) | 2.67 | 5.06 | -16.33 | 1 | 5 | 0 | 54 | 317.414 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 5.41 | -35.04 | 2 | 5 | 1 | 56 | 318.422 | 4 | ↓ |