In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2009 | 17 | Yes |
None
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) | 2.51 | 7.19 | -33.64 | 2 | 2 | 1 | 25 | 232.347 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.51 | 5.59 | -3.4 | 1 | 2 | 0 | 23 | 231.339 | 3 | ↓ |