In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 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) | 0.72 | 3.77 | -94.87 | 4 | 4 | 2 | 45 | 251.374 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.72 | 1.39 | -45.87 | 3 | 4 | 1 | 43 | 250.366 | 6 | ↓ |