General Information of the Compound
| Compound ID |
CP0167779
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| Compound Name |
3-(2-methoxyethyl)-1-[(3-methoxyphenyl)methyl]-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C26H32N4O6S
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| Molecular Weight |
528.631
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| Canonical SMILES |
COCCc1nn(Cc2cccc(OC)c2)cc1C(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCOCC1
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| InChI |
InChI=1S/C26H32N4O6S/c1-19-7-8-21(16-25(19)37(32,33)30-10-13-36-14-11-30)27-26(31)23-18-29(28-24(23)9-12-34-2)17-20-5-4-6-22(15-20)35-3/h4-8,15-16,18H,9-14,17H2,1-3H3,(H,27,31)
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| InChIKey |
HOZHNHILHIGHLO-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