In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 35 | 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) | 2.02 | 6.22 | -68.58 | 0 | 9 | -1 | 105 | 481.525 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 8.56 | -84.12 | 1 | 9 | 0 | 106 | 482.533 | 10 | ↓ |