| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 13th, 2006 | 13 | Yes |
Popular Name: (5-Bromo-1-benzothien-3-yl)acetonitrile (5-Bromo-1-benzothien-3-yl)aceto…
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CAS Number: 23799-61-3
| 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) | 3.58 | 1.29 | -8.84 | 0 | 1 | 0 | 23 | 252.136 | 1 | ↓ |
