General Information of the Compound
| Compound ID |
CP0390530
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| Compound Name |
1-Methyl-5-(2-oxo-3-pentyl-2,3-dihydro-1H-benzoimidazol-5-yl)-1H-pyrrole-2-carbonitrile
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| Structure |
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| Formula |
C18H20N4O
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| Molecular Weight |
308.385
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| Canonical SMILES |
CCCCCn1c2cc(ccc2[nH]c1=O)-c1ccc(C#N)n1C
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| InChI |
InChI=1S/C18H20N4O/c1-3-4-5-10-22-17-11-13(6-8-15(17)20-18(22)23)16-9-7-14(12-19)21(16)2/h6-9,11H,3-5,10H2,1-2H3,(H,20,23)
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| InChIKey |
QJDGUQDSNKKINO-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