In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 32 | 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) | 0.48 | 7.36 | -99.33 | 3 | 8 | 2 | 71 | 450.624 | 10 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 5.57 | -44.99 | 2 | 8 | 1 | 70 | 449.616 | 10 | ↓ |