In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 19 | 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) | 2.19 | 7.25 | -46.77 | 1 | 5 | -1 | 87 | 273.349 | 12 | ↓ |
Lo Low (pH 4.5-6) | 2.19 | 5.27 | -9.63 | 2 | 5 | 0 | 84 | 274.357 | 12 | ↓ |