In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 36 | 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) | 5.07 | 8.82 | -11.31 | 2 | 5 | 0 | 52 | 483.656 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.07 | 11.17 | -49.33 | 3 | 5 | 1 | 53 | 484.664 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.07 | 11.22 | -41.62 | 3 | 5 | 1 | 53 | 484.664 | 8 | ↓ |