In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2007 | 35 | 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) | 5.74 | 13.49 | -35.85 | 2 | 6 | 0 | 80 | 496.966 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.74 | 12.12 | -47.08 | 1 | 6 | -1 | 76 | 495.958 | 10 | ↓ |