In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 3rd, 2006 | 26 | 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) | 6.09 | 7.48 | -5.69 | 2 | 3 | 0 | 45 | 368.546 | 3 | ↓ |
Lo Low (pH 4.5-6) | 6.09 | 9.06 | -32.36 | 3 | 3 | 1 | 46 | 369.554 | 3 | ↓ |