In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 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) | 4.87 | 11.3 | -44.97 | 0 | 2 | -1 | 40 | 247.358 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.87 | 9.33 | -6.72 | 1 | 2 | 0 | 37 | 248.366 | 7 | ↓ |