General Information of the Compound
| Compound ID |
CP0529953
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| Compound Name |
N-[3-(6-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 |
COc1ccc2CN(CCCNS(=O)(=O)c3cccc4ccccc34)CCc2c1
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| InChI |
InChI=1S/C23H26N2O3S/c1-28-21-11-10-20-17-25(15-12-19(20)16-21)14-5-13-24-29(26,27)23-9-4-7-18-6-2-3-8-22(18)23/h2-4,6-11,16,24H,5,12-15,17H2,1H3
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| InChIKey |
NIWXUQLICVVUGY-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