In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 34 | 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) | 2.77 | 7.28 | -19.2 | 1 | 9 | 0 | 88 | 483.539 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 8.96 | -60.68 | 2 | 9 | 1 | 89 | 484.547 | 6 | ↓ |