In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 28 | 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) | 1.90 | 5.39 | -13.84 | 3 | 8 | 0 | 97 | 404.492 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 4.34 | -52.49 | 2 | 8 | -1 | 100 | 403.484 | 6 | ↓ |