In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 16 | 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) | 0.95 | 1.75 | -10.48 | 1 | 4 | 0 | 42 | 248.754 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.95 | 4.15 | -45.92 | 2 | 4 | 1 | 43 | 249.762 | 7 | ↓ |