In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 18 | 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) | 1.26 | 4.77 | -42.77 | 2 | 5 | 1 | 50 | 249.338 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 2.3 | -11.1 | 1 | 5 | 0 | 48 | 248.33 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 2.6 | -37.28 | 2 | 5 | 1 | 50 | 249.338 | 3 | ↓ |