General Information of the Compound
| Compound ID |
CP0516462
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| Compound Name |
N-(3-carbazol-9-yl-2-hydroxypropyl)-N-(4,4-difluorocyclohexyl)methanesulfonamide
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| Structure |
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| Formula |
C22H26F2N2O3S
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| Molecular Weight |
436.524
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| Canonical SMILES |
CS(=O)(=O)N(CC(O)Cn1c2ccccc2c2ccccc12)C1CCC(F)(F)CC1
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| InChI |
InChI=1S/C22H26F2N2O3S/c1-30(28,29)26(16-10-12-22(23,24)13-11-16)15-17(27)14-25-20-8-4-2-6-18(20)19-7-3-5-9-21(19)25/h2-9,16-17,27H,10-15H2,1H3
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| InChIKey |
NYPXLADZHKJEIQ-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