In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 32 | 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) | 1.39 | 4.93 | -145.82 | 2 | 8 | -2 | 147 | 470.43 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 3.78 | -51.85 | 3 | 8 | -1 | 144 | 471.438 | 4 | ↓ |