In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2008 | 27 | 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) | 3.07 | 6.83 | -16.92 | 1 | 6 | 0 | 77 | 420.537 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 8.02 | -62.56 | 0 | 6 | -1 | 79 | 419.529 | 5 | ↓ |