General Information of the Compound
| Compound ID |
CP0459136
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| Compound Name |
N-[4-(5-cyano-1-methylpyrrol-2-yl)phenyl]propanamide
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| Structure |
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| Formula |
C15H15N3O
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| Molecular Weight |
253.305
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| Canonical SMILES |
CCC(=O)Nc1ccc(cc1)-c1ccc(C#N)n1C
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| InChI |
InChI=1S/C15H15N3O/c1-3-15(19)17-12-6-4-11(5-7-12)14-9-8-13(10-16)18(14)2/h4-9H,3H2,1-2H3,(H,17,19)
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| InChIKey |
QHLYHKQLBQGUHK-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