General Information of the Compound
| Compound ID |
CP0267346
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| Compound Name |
4-methoxy-1-(4-(2-methoxypropan-2-yl)phenylsulfonyl)-4-methylazepane
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| Structure |
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| Formula |
C18H29NO4S
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| Molecular Weight |
355.5
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| Canonical SMILES |
COC(C)(C)c1ccc(cc1)S(=O)(=O)N1CCCC(C)(CC1)OC
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| InChI |
InChI=1S/C18H29NO4S/c1-17(2,22-4)15-7-9-16(10-8-15)24(20,21)19-13-6-11-18(3,23-5)12-14-19/h7-10H,6,11-14H2,1-5H3
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| InChIKey |
PHXOHFAKIXADEA-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