In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2010 | 35 | 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) | 0.74 | 11.12 | -67.79 | 1 | 9 | -1 | 117 | 483.541 | 11 | ↓ |
Mid Mid (pH 6-8) | 0.74 | 11.97 | -60.29 | 2 | 9 | 0 | 122 | 484.549 | 11 | ↓ |