General Information of the Compound
| Compound ID |
CP0282152
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| Compound Name |
1-(4-hydroxybutyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-3-(4-methylphenyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C26H32N4O5S
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| Molecular Weight |
512.632
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| Canonical SMILES |
Cc1ccc(cc1)-c1nn(CCCCO)cc1C(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCOCC1
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| InChI |
InChI=1S/C26H32N4O5S/c1-19-5-8-21(9-6-19)25-23(18-29(28-25)11-3-4-14-31)26(32)27-22-10-7-20(2)24(17-22)36(33,34)30-12-15-35-16-13-30/h5-10,17-18,31H,3-4,11-16H2,1-2H3,(H,27,32)
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| InChIKey |
VIVHUFLZAROTOQ-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