General Information of the Compound
| Compound ID |
CP0515548
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| Compound Name |
3-Fluoro-5-(2-oxo-3-pentyl-2,3-dihydro-1H-benzoimidazol-5-yl)-benzonitrile
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| Structure |
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| Formula |
C19H18FN3O
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| Molecular Weight |
323.371
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| Canonical SMILES |
CCCCCn1c2cc(ccc2[nH]c1=O)-c1cc(F)cc(c1)C#N
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| InChI |
InChI=1S/C19H18FN3O/c1-2-3-4-7-23-18-11-14(5-6-17(18)22-19(23)24)15-8-13(12-21)9-16(20)10-15/h5-6,8-11H,2-4,7H2,1H3,(H,22,24)
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| InChIKey |
GASIXBXBRGROOP-UHFFFAOYSA-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