In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2006 | 17 | 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) | 1.43 | -6.69 | -14.12 | 2 | 5 | 0 | 75 | 274.367 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.43 | -7.65 | -50.08 | 2 | 5 | -1 | 75 | 273.359 | 4 | ↓ |