In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2009 | 34 | No |
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) | 3.51 | 9.15 | -59.39 | 0 | 7 | -1 | 82 | 463.554 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 11.49 | -73.4 | 1 | 7 | 0 | 83 | 464.562 | 8 | ↓ |