In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2009 | 33 | 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) | 2.56 | 7.29 | -72.99 | 1 | 8 | 1 | 96 | 472.539 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 4.51 | -20.87 | 0 | 8 | 0 | 95 | 471.531 | 4 | ↓ |