In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 14th, 2007 | 35 | 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) | 4.79 | 8.69 | -22.15 | 3 | 7 | 0 | 96 | 486.959 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.25 | 8.48 | -143.31 | 1 | 7 | -2 | 102 | 484.943 | 5 | ↓ |