In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 39 | 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) | -0.94 | 7.87 | -67.09 | 5 | 10 | -1 | 165 | 537.637 | 11 | ↓ |
Mid Mid (pH 6-8) | -0.94 | 8.19 | -90.87 | 6 | 10 | 0 | 167 | 538.645 | 11 | ↓ |