In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 12th, 2008 | 20 | 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) | 4.77 | 9.78 | -9.83 | 0 | 1 | 0 | 13 | 281.355 | 0 | ↓ |
Lo Low (pH 4.5-6) | 4.77 | 9.98 | -29.27 | 1 | 1 | 1 | 14 | 282.363 | 0 | ↓ |