General Information of the Compound
| Compound ID |
CP0546166
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| Compound Name |
N-[3-[1'-(cyclohexanecarbonyl)-5'-methyl-2',4-dioxospiro[1,3-thiazolidine-2,3'-indole]-3-yl]propyl]-2,3,4,5,6-pentafluorobenzamide
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| Structure |
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| Formula |
C28H26F5N3O4S
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| Molecular Weight |
595.59
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| Canonical SMILES |
Cc1ccc2N(C(=O)C3CCCCC3)C(=O)C3(SCC(=O)N3CCCNC(=O)c3c(F)c(F)c(F)c(F)c3F)c2c1
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| InChI |
InChI=1S/C28H26F5N3O4S/c1-14-8-9-17-16(12-14)28(27(40)36(17)26(39)15-6-3-2-4-7-15)35(18(37)13-41-28)11-5-10-34-25(38)19-20(29)22(31)24(33)23(32)21(19)30/h8-9,12,15H,2-7,10-11,13H2,1H3,(H,34,38)
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| InChIKey |
WCVRKHYLCLTXGK-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