General Information of the Compound
| Compound ID |
CP0569587
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| Compound Name |
N-ethyl-4-[4-(3-methoxypyridin-2-yl)piperidin-1-yl]azepane-1-sulfonamide
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| Structure |
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| Formula |
C19H32N4O3S
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| Molecular Weight |
396.557
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| Canonical SMILES |
CCNS(=O)(=O)N1CCCC(CC1)N1CCC(CC1)c1ncccc1OC
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| InChI |
InChI=1S/C19H32N4O3S/c1-3-21-27(24,25)23-12-5-6-17(10-15-23)22-13-8-16(9-14-22)19-18(26-2)7-4-11-20-19/h4,7,11,16-17,21H,3,5-6,8-10,12-15H2,1-2H3
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| InChIKey |
NSZXDRBZOINNIX-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