General Information of the Compound
| Compound ID |
CP0072480
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| Compound Name |
3-[1-(4-fluorophenyl)indazol-5-yl]-2,2-dimethyl-N-(1,3,4-thiadiazol-2-yl)propanamide
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| Structure |
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| Formula |
C20H18FN5OS
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| Molecular Weight |
395.463
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| Canonical SMILES |
CC(C)(Cc1ccc2n(ncc2c1)-c1ccc(F)cc1)C(=O)Nc1nncs1
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| InChI |
InChI=1S/C20H18FN5OS/c1-20(2,18(27)24-19-25-22-12-28-19)10-13-3-8-17-14(9-13)11-23-26(17)16-6-4-15(21)5-7-16/h3-9,11-12H,10H2,1-2H3,(H,24,25,27)
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| InChIKey |
JSXKKUKCBCVMHI-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