| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2009 | 34 | Yes |
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CAS Number: [68003-28-1]
| 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) | -1.03 | 2.36 | -92.35 | 8 | 10 | 2 | 150 | 468.558 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.03 | 1.13 | -53.55 | 7 | 10 | 1 | 145 | 467.55 | 0 | ↓ |
| Hi High (pH 8-9.5) | -1.03 | -0.3 | -40.77 | 6 | 10 | 0 | 140 | 466.542 | 0 | ↓ |
