In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2006 | 23 | 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) | -4.30 | -12.91 | -17.82 | 8 | 11 | 0 | 197 | 342.297 | 8 | ↓ |
Hi High (pH 8-9.5) | -4.79 | -12.48 | -62.51 | 7 | 11 | -1 | 200 | 341.289 | 8 | ↓ |