In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 23 | 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) | 4.36 | 10.94 | -41.85 | 1 | 2 | 1 | 8 | 345.919 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.36 | 8.59 | -4.96 | 0 | 2 | 0 | 6 | 344.911 | 1 | ↓ |