General Information of the Compound
| Compound ID |
CP0468262
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| Compound Name |
4-[4-[[cyclopentyl-(4-methoxyphenyl)sulfonylamino]methyl]-1,3-thiazol-2-yl]-N,N-dimethylbenzamide
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| Structure |
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| Formula |
C25H29N3O4S2
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| Molecular Weight |
499.658
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| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)N(Cc1csc(n1)-c1ccc(cc1)C(=O)N(C)C)C1CCCC1
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| InChI |
InChI=1S/C25H29N3O4S2/c1-27(2)25(29)19-10-8-18(9-11-19)24-26-20(17-33-24)16-28(21-6-4-5-7-21)34(30,31)23-14-12-22(32-3)13-15-23/h8-15,17,21H,4-7,16H2,1-3H3
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| InChIKey |
MKBUSCBMDIFKTG-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