In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 15 | 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) | 3.07 | 7.66 | -48.47 | 0 | 2 | -1 | 40 | 203.261 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.07 | 6.57 | -5.46 | 1 | 2 | 0 | 37 | 204.269 | 4 | ↓ |