In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 11 | 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) | -2.80 | -4.74 | -41.58 | 5 | 5 | 1 | 88 | 163.197 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.80 | -5.14 | -13.25 | 4 | 5 | 0 | 87 | 162.189 | 5 | ↓ |