In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 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) | 5.04 | 13.79 | -77.25 | 1 | 6 | 0 | 74 | 529.475 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.49 | 13.09 | -44.33 | 2 | 6 | 1 | 71 | 530.483 | 9 | ↓ |