General Information of the Compound
| Compound ID |
CP0537683
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| Compound Name |
2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-(9-pentylcarbazol-3-yl)ethanone
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| Structure |
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| Formula |
C23H28N2O3S
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| Molecular Weight |
412.555
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| Canonical SMILES |
CCCCCn1c2ccccc2c2cc(ccc12)C(=O)CN1CCS(=O)(=O)CC1
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| InChI |
InChI=1S/C23H28N2O3S/c1-2-3-6-11-25-21-8-5-4-7-19(21)20-16-18(9-10-22(20)25)23(26)17-24-12-14-29(27,28)15-13-24/h4-5,7-10,16H,2-3,6,11-15,17H2,1H3
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| InChIKey |
FFTOPQAXWDTORU-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