In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | No |
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) | 2.13 | 6.03 | -2.33 | 2 | 2 | 0 | 29 | 208.33 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 5.9 | -41.92 | 3 | 2 | 1 | 31 | 209.338 | 1 | ↓ |