General Information of the Compound
| Compound ID |
CP0503097
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| Compound Name |
3-methyl-N-(4-thiazol-2-ylpiperidin-1-ylmethyl)-benzamide
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| Structure |
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| Formula |
C17H21N3OS
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| Molecular Weight |
315.442
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| Canonical SMILES |
Cc1cccc(c1)C(=O)NCN1CCC(CC1)c1nccs1
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| InChI |
InChI=1S/C17H21N3OS/c1-13-3-2-4-15(11-13)16(21)19-12-20-8-5-14(6-9-20)17-18-7-10-22-17/h2-4,7,10-11,14H,5-6,8-9,12H2,1H3,(H,19,21)
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| InChIKey |
ATPINSKUJGBMGW-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