In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2009 | 26 | 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) | 2.38 | 7.52 | -11.61 | 0 | 5 | 0 | 42 | 356.466 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 9.74 | -51.77 | 1 | 5 | 1 | 43 | 357.474 | 3 | ↓ |