General Information of the Compound
| Compound ID |
CP0426134
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| Compound Name |
N-[4-[3-(4-cyanophenyl)-1-adamantyl]phenyl]methanesulfonamide
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| Structure |
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| Formula |
C24H26N2O2S
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| Molecular Weight |
406.551
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(cc1)C12CC3CC(C1)CC(C3)(C2)c1ccc(cc1)C#N
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| InChI |
InChI=1S/C24H26N2O2S/c1-29(27,28)26-22-8-6-21(7-9-22)24-13-18-10-19(14-24)12-23(11-18,16-24)20-4-2-17(15-25)3-5-20/h2-9,18-19,26H,10-14,16H2,1H3
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| InChIKey |
DNFJXOOCSWHZAZ-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