General Information of the Compound
| Compound ID |
CP0382662
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| Compound Name |
N-[[1-[2-(2-propan-2-yloxyphenoxy)ethyl]piperidin-4-yl]methyl]quinoline-8-sulfonamide
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| Structure |
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| Formula |
C26H33N3O4S
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| Molecular Weight |
483.634
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| Canonical SMILES |
CC(C)Oc1ccccc1OCCN1CCC(CNS(=O)(=O)c2cccc3cccnc23)CC1
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| InChI |
InChI=1S/C26H33N3O4S/c1-20(2)33-24-10-4-3-9-23(24)32-18-17-29-15-12-21(13-16-29)19-28-34(30,31)25-11-5-7-22-8-6-14-27-26(22)25/h3-11,14,20-21,28H,12-13,15-19H2,1-2H3
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| InChIKey |
HVOJLKOTYQGALX-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