General Information of the Compound
| Compound ID |
CP0339359
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| Compound Name |
5-cyano-N-[2-(cyclohexen-1-yl)-4-(2-hydroxyethyl)phenyl]-1H-imidazole-2-carboxamide
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| Structure |
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| Formula |
C19H20N4O2
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| Molecular Weight |
336.395
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| Canonical SMILES |
OCCc1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1
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| InChI |
InChI=1S/C19H20N4O2/c20-11-15-12-21-18(22-15)19(25)23-17-7-6-13(8-9-24)10-16(17)14-4-2-1-3-5-14/h4,6-7,10,12,24H,1-3,5,8-9H2,(H,21,22)(H,23,25)
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| InChIKey |
TUFVFYQJYMMHMV-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