In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 32 | Yes |
Popular Name: LS-75522 LS-75522
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) | 1.02 | 7.44 | -62.25 | 5 | 9 | 1 | 139 | 449.524 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 6.6 | -17.67 | 4 | 9 | 0 | 134 | 448.516 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 7.98 | -44.81 | 4 | 9 | 0 | 142 | 448.516 | 9 | ↓ |