General Information of the Compound
| Compound ID |
CP0038053
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| Compound Name |
N-[5-(5-cyanopyridin-3-yl)-2,3-dihydro-1H-inden-2-yl]propane-2-sulfonamide
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| Structure |
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| Formula |
C18H19N3O2S
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| Molecular Weight |
341.436
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| Canonical SMILES |
CC(C)S(=O)(=O)NC1Cc2ccc(cc2C1)-c1cncc(c1)C#N
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| InChI |
InChI=1S/C18H19N3O2S/c1-12(2)24(22,23)21-18-7-15-4-3-14(6-16(15)8-18)17-5-13(9-19)10-20-11-17/h3-6,10-12,18,21H,7-8H2,1-2H3
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| InChIKey |
KGEABTFMCTZXTF-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