General Information of the Compound
| Compound ID |
CP0367331
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| Compound Name |
3-bromo-4-[(5R)-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl]benzonitrile
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| Structure |
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| Formula |
C13H10BrN3
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| Molecular Weight |
288.148
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| Canonical SMILES |
Brc1cc(ccc1[C@H]1CCc2cncn12)C#N
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| InChI |
InChI=1S/C13H10BrN3/c14-12-5-9(6-15)1-3-11(12)13-4-2-10-7-16-8-17(10)13/h1,3,5,7-8,13H,2,4H2/t13-/m1/s1
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| InChIKey |
FLRGANPHGAPABO-CYBMUJFWSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound