In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | 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) | 5.21 | 7.56 | -7.33 | 1 | 3 | 0 | 46 | 317.175 | 2 | ↓ |
Hi High (pH 8-9.5) | 5.21 | 8.32 | -42.24 | 0 | 3 | -1 | 49 | 316.167 | 2 | ↓ |