In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 13 | 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) | 2.76 | 8.31 | -51.4 | 0 | 2 | -1 | 40 | 219.351 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | 7.19 | -12.77 | 1 | 2 | 0 | 37 | 220.359 | 6 | ↓ |