In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2010 | 18 | Yes |
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) | 0.82 | 8.31 | -40.48 | 1 | 4 | 1 | 33 | 247.297 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.82 | 5.96 | -4.97 | 0 | 4 | 0 | 32 | 246.289 | 1 | ↓ |