In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 11th, 2009 | 11 | Yes |
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) | -1.36 | -3.12 | -51 | 5 | 4 | 1 | 77 | 161.225 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.36 | -3.5 | -9.22 | 4 | 4 | 0 | 75 | 160.217 | 6 | ↓ |