General Information of the Compound
| Compound ID |
CP0178140
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| Compound Name |
1-methyl-2-(1-propylpiperidin-4-yl)-1H-1,3-benzodiazole-4-carboxamide
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| Structure |
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| Formula |
C17H24N4O
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| Molecular Weight |
300.406
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| Canonical SMILES |
CCCN1CCC(CC1)c1nc2c(cccc2n1C)C(N)=O
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| InChI |
InChI=1S/C17H24N4O/c1-3-9-21-10-7-12(8-11-21)17-19-15-13(16(18)22)5-4-6-14(15)20(17)2/h4-6,12H,3,7-11H2,1-2H3,(H2,18,22)
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| InChIKey |
PYCOJOVNVSUACM-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