In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 12 | 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) | 2.31 | 4.27 | -5.78 | 0 | 2 | 0 | 16 | 202.71 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 4.68 | -26.42 | 1 | 2 | 1 | 17 | 203.718 | 2 | ↓ |