General Information of the Compound
| Compound ID |
CP0336445
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| Compound Name |
3-[1-(4-fluorophenyl)indazol-5-yl]-2,2,5-trimethyl-N-(1,3,4-thiadiazol-2-yl)hexanamide
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| Structure |
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| Formula |
C24H26FN5OS
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| Molecular Weight |
451.571
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| Canonical SMILES |
CC(C)CC(c1ccc2n(ncc2c1)-c1ccc(F)cc1)C(C)(C)C(=O)Nc1nncs1
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| InChI |
InChI=1S/C24H26FN5OS/c1-15(2)11-20(24(3,4)22(31)28-23-29-26-14-32-23)16-5-10-21-17(12-16)13-27-30(21)19-8-6-18(25)7-9-19/h5-10,12-15,20H,11H2,1-4H3,(H,28,29,31)
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| InChIKey |
VFKDEFSJOCZLKQ-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