In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2006 | 22 | 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) | 4.05 | 5.86 | -10.77 | 1 | 4 | 0 | 54 | 294.354 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.05 | 6.8 | -30.54 | 2 | 4 | 1 | 56 | 295.362 | 4 | ↓ |