In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 13 | 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) | 1.69 | 4.31 | -35.2 | 2 | 2 | 1 | 20 | 183.319 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.69 | 6.22 | -110.15 | 3 | 2 | 2 | 21 | 184.327 | 2 | ↓ |