In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2009 | 17 | Yes |
None
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) | 2.39 | 5.68 | -24.62 | 5 | 5 | 1 | 88 | 233.295 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 5.19 | -8.02 | 4 | 5 | 0 | 87 | 232.287 | 4 | ↓ |