General Information of the Compound
| Compound ID |
CP0194254
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| Compound Name |
4-(1H-imidazol-1-yl)-N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)benzamide
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| Structure |
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| Formula |
C25H31N5O2
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| Molecular Weight |
433.556
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-n2ccnc2)CC1
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| InChI |
InChI=1S/C25H31N5O2/c1-32-24-7-3-2-6-23(24)29-18-16-28(17-19-29)14-5-4-12-27-25(31)21-8-10-22(11-9-21)30-15-13-26-20-30/h2-3,6-11,13,15,20H,4-5,12,14,16-19H2,1H3,(H,27,31)
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| InChIKey |
NTASTGHPPLINPW-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