In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 20th, 2006 | 22 | 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) | 3.25 | 7.27 | -39.31 | 2 | 3 | 1 | 30 | 297.422 | 1 | ↓ |
Hi High (pH 8-9.5) | 3.25 | 4.96 | -5.44 | 1 | 3 | 0 | 28 | 296.414 | 1 | ↓ |