In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2009 | 37 | 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) | 3.43 | 9.02 | -61.53 | 0 | 8 | -1 | 85 | 504.607 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.43 | 11.35 | -76.85 | 1 | 8 | 0 | 87 | 505.615 | 10 | ↓ |