In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | 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) | 3.67 | 5.26 | -6.68 | 2 | 3 | 0 | 52 | 276.748 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.67 | 5.22 | -28.47 | 3 | 3 | 1 | 53 | 277.756 | 2 | ↓ |