General Information of the Compound
| Compound ID |
CP0472005
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| Compound Name |
4-(5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl)-N-(morpholinosulfonyl)butanamide
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| Structure |
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| Formula |
C23H23FN4O4S
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| Molecular Weight |
470.526
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| Canonical SMILES |
Fc1ccc(cc1)-c1[nH]c2ccc(cc2c1CCCC(=O)NS(=O)(=O)N1CCOCC1)C#N
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| InChI |
InChI=1S/C23H23FN4O4S/c24-18-7-5-17(6-8-18)23-19(20-14-16(15-25)4-9-21(20)26-23)2-1-3-22(29)27-33(30,31)28-10-12-32-13-11-28/h4-9,14,26H,1-3,10-13H2,(H,27,29)
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| InChIKey |
OTHPPVLCKCFVAW-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