In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 12 | Yes |
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) | -0.93 | 0.34 | -6.34 | 3 | 3 | 0 | 55 | 182.61 | 0 | ↓ |
Mid Mid (pH 6-8) | -0.93 | 0.59 | -50.15 | 4 | 3 | 1 | 57 | 183.618 | 0 | ↓ |
Mid Mid (pH 6-8) | -0.93 | 0.65 | -48.4 | 4 | 3 | 1 | 57 | 183.618 | 0 | ↓ |