In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2008 | 34 | 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) | -2.17 | 6.88 | -128.68 | 6 | 13 | -1 | 201 | 472.482 | 9 | ↓ |
Lo Low (pH 4.5-6) | -2.17 | 4.86 | -82.13 | 7 | 13 | 0 | 198 | 473.49 | 9 | ↓ |
Lo Low (pH 4.5-6) | -2.17 | 1.49 | -89.35 | 6 | 13 | -1 | 197 | 472.482 | 9 | ↓ |