In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 29 | 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) | 0.71 | 11.76 | -111.72 | 2 | 6 | 0 | 82 | 409.408 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.04 | 8.52 | -98.5 | 3 | 6 | 1 | 85 | 410.416 | 4 | ↓ |