In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 16 | 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) | 0.65 | 1.56 | -38.36 | 3 | 4 | 1 | 46 | 231.36 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 2.92 | -103.02 | 4 | 4 | 2 | 51 | 232.368 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.65 | 0.56 | -38.56 | 3 | 4 | 1 | 49 | 231.36 | 8 | ↓ |