| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 35 | Yes |
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CAS Number: 747412-64-2
| 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) | 4.85 | 4.52 | -17.71 | 3 | 8 | 0 | 108 | 479.577 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.19 | 8.69 | -105.25 | 3 | 8 | 0 | 112 | 479.577 | 6 | ↓ |
