In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 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) | 1.48 | 3.6 | -34.82 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.48 | 3.61 | -35.91 | 3 | 4 | 1 | 43 | 250.366 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.48 | 1.22 | -4.46 | 2 | 4 | 0 | 42 | 249.358 | 4 | ↓ |