General Information of the Compound
| Compound ID |
CP0307954
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| Compound Name |
3-(2-methoxyethyl)-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1-propan-2-ylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C21H30N4O5S
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| Molecular Weight |
450.561
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| Canonical SMILES |
COCCc1nn(cc1C(=O)Nc1ccc(C)c(c1)S(=O)(=O)N1CCOCC1)C(C)C
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| InChI |
InChI=1S/C21H30N4O5S/c1-15(2)25-14-18(19(23-25)7-10-29-4)21(26)22-17-6-5-16(3)20(13-17)31(27,28)24-8-11-30-12-9-24/h5-6,13-15H,7-12H2,1-4H3,(H,22,26)
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| InChIKey |
ATTBYMJADYJBDE-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