General Information of the Compound
| Compound ID |
CP0579554
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| Compound Name |
N-(5-chloro-2-methoxyphenyl)-7-(4-methylpiperidin-1-yl)sulfonyl-2,7-diazaspiro[3.5]nonane-2-carboxamide
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| Structure |
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| Formula |
C21H31ClN4O4S
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| Molecular Weight |
471.023
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| Canonical SMILES |
COc1ccc(Cl)cc1NC(=O)N1CC2(C1)CCN(CC2)S(=O)(=O)N1CCC(C)CC1
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| InChI |
InChI=1S/C21H31ClN4O4S/c1-16-5-9-25(10-6-16)31(28,29)26-11-7-21(8-12-26)14-24(15-21)20(27)23-18-13-17(22)3-4-19(18)30-2/h3-4,13,16H,5-12,14-15H2,1-2H3,(H,23,27)
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| InChIKey |
RQBAXDFCDODHMK-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