In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 26 | 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) | 5.52 | 11.6 | -39.39 | 2 | 2 | 1 | 16 | 394.341 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.52 | 12.69 | -123.7 | 3 | 2 | 2 | 21 | 395.349 | 4 | ↓ |