General Information of the Compound
Compound ID |
CP0395152
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Compound Name |
N-[3-(5-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)propyl]naphthalene-1-sulfonamide
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Structure |
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Formula |
C23H26N2O3S
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Molecular Weight |
410.539
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Canonical SMILES |
COc1cccc2CN(CCCNS(=O)(=O)c3cccc4ccccc34)CCc12
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InChI |
InChI=1S/C23H26N2O3S/c1-28-22-11-4-9-19-17-25(16-13-20(19)22)15-6-14-24-29(26,27)23-12-5-8-18-7-2-3-10-21(18)23/h2-5,7-12,24H,6,13-17H2,1H3
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InChIKey |
XDCPKBSJGQDCSS-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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