In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 28 | 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) | 3.05 | 8.58 | -51.04 | 2 | 6 | 1 | 59 | 404.918 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 6.36 | -9.23 | 1 | 6 | 0 | 58 | 403.91 | 6 | ↓ |