In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | 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) | 0.79 | 8.09 | -19.91 | 0 | 5 | 0 | 64 | 261.277 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 6.98 | -58.71 | 0 | 5 | -1 | 70 | 260.269 | 5 | ↓ |