In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 33 | 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) | 3.87 | 6.85 | -13.54 | 2 | 8 | 0 | 83 | 517.424 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 8.72 | -56.89 | 3 | 8 | 1 | 84 | 518.432 | 6 | ↓ |