General Information of the Compound
| Compound ID |
CP0502748
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| Compound Name |
N-(1-benzylpiperidin-4-yl)-5-chloro-2-[(4-methoxyphenyl)methylamino]pyridine-3-carboxamide
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| Structure |
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| Formula |
C26H29ClN4O2
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| Molecular Weight |
464.997
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| Canonical SMILES |
COc1ccc(CNc2ncc(Cl)cc2C(=O)NC2CCN(Cc3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C26H29ClN4O2/c1-33-23-9-7-19(8-10-23)16-28-25-24(15-21(27)17-29-25)26(32)30-22-11-13-31(14-12-22)18-20-5-3-2-4-6-20/h2-10,15,17,22H,11-14,16,18H2,1H3,(H,28,29)(H,30,32)
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| InChIKey |
FPDUAIUNJYJJTC-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