In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2006 | 36 | 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) | 3.48 | -0.44 | -18.42 | 1 | 11 | 0 | 152 | 494.504 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.48 | -0.68 | -19.61 | 1 | 11 | 0 | 152 | 494.504 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.66 | -1.57 | -18.39 | 1 | 11 | 0 | 152 | 494.504 | 11 | ↓ |