General Information of the Compound
| Compound ID |
CP0759846
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| Compound Name |
2-Methyl-N-[3-(2-{[(1-methylethyl)sulfonyl]amino}-2,3-dihydro-1H-inden-5-10yl)phenyl]propanamide
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| Structure |
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| Formula |
C22H28N2O3S
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| Molecular Weight |
400.544
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| Canonical SMILES |
CC(C)C(=O)Nc1cccc(-c2ccc3c(c2)CC(NS(=O)(=O)C(C)C)C3)c1
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| InChI |
InChI=1S/C22H28N2O3S/c1-14(2)22(25)23-20-7-5-6-16(11-20)17-8-9-18-12-21(13-19(18)10-17)24-28(26,27)15(3)4/h5-11,14-15,21,24H,12-13H2,1-4H3,(H,23,25)
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| InChIKey |
KTKAUYATGKDLDA-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