In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 34 | 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) | 1.22 | 4.87 | -69.08 | 1 | 11 | -1 | 154 | 471.442 | 11 | ↓ |
Mid Mid (pH 6-8) | 0.63 | -1.94 | -18.5 | 1 | 11 | 0 | 148 | 472.45 | 11 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 5 | -27.34 | 2 | 11 | 0 | 151 | 472.45 | 10 | ↓ |