General Information of the Compound
| Compound ID |
CP0956942
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| Compound Name |
2-(4-(tert-Butylphenyl)-4-(4-(2-fluoroethyl)piperazin-1-yl)-1H-benzo[d]imidazole
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| Structure |
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| Formula |
C23H29FN4
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| Molecular Weight |
380.511
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| Canonical SMILES |
CC(C)(C)c1ccc(-c2nc3c(N4CCN(CCF)CC4)cccc3[nH]2)cc1
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| InChI |
InChI=1S/C23H29FN4/c1-23(2,3)18-9-7-17(8-10-18)22-25-19-5-4-6-20(21(19)26-22)28-15-13-27(12-11-24)14-16-28/h4-10H,11-16H2,1-3H3,(H,25,26)
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| InChIKey |
KAWULIAMMOOOQW-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