In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 3rd, 2006 | 11 | 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) | 2.60 | -1.41 | -39.7 | 2 | 1 | 1 | 16 | 174.333 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.60 | -2.37 | -52.83 | 2 | 1 | 0 | 16 | 173.325 | 4 | ↓ |