In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 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) | -0.82 | 3.03 | -53.17 | 3 | 5 | -1 | 95 | 247.274 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.82 | 1.27 | -13.87 | 4 | 5 | 0 | 92 | 248.282 | 5 | ↓ |