In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 19th, 2009 | 35 | 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) | 3.56 | 7.29 | -21.24 | 4 | 8 | 0 | 122 | 488.931 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.56 | 8.22 | -49.68 | 3 | 8 | -1 | 124 | 487.923 | 7 | ↓ |