General Information of the Compound
| Compound ID |
CP0035830
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| Compound Name |
2-(4-methylpiperidin-4-yl)-1H-1,3-benzodiazole-4-carboxamide
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| Structure |
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| Formula |
C14H18N4O
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| Molecular Weight |
258.325
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| Canonical SMILES |
CC1(CCNCC1)c1nc2cccc(C(N)=O)c2[nH]1
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| InChI |
InChI=1S/C14H18N4O/c1-14(5-7-16-8-6-14)13-17-10-4-2-3-9(12(15)19)11(10)18-13/h2-4,16H,5-8H2,1H3,(H2,15,19)(H,17,18)
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| InChIKey |
PWESUKOHBQOSBW-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