In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 14 | 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) | 0.61 | 6 | -37.11 | 1 | 4 | 0 | 54 | 201.266 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 3.9 | -50.69 | 0 | 4 | -1 | 53 | 200.258 | 6 | ↓ |