General Information of the Compound
| Compound ID |
CP0522637
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| Compound Name |
1-benzyl-N-(1H-5-indazolyl)piperidine-3-carboxamide
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| Structure |
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| Formula |
C20H22N4O
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| Molecular Weight |
334.423
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| Canonical SMILES |
O=C(Nc1ccc2[nH]ncc2c1)C1CCCN(Cc2ccccc2)C1
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| InChI |
InChI=1S/C20H22N4O/c25-20(22-18-8-9-19-17(11-18)12-21-23-19)16-7-4-10-24(14-16)13-15-5-2-1-3-6-15/h1-3,5-6,8-9,11-12,16H,4,7,10,13-14H2,(H,21,23)(H,22,25)
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| InChIKey |
PUDPIQFNZNNYGT-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