General Information of the Compound
| Compound ID |
CP0306770
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| Compound Name |
7-hydroxy-N-[3-(4-methylimidazol-1-yl)propyl]-2-thiophen-2-yl-1H-benzimidazole-4-carboxamide
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| Structure |
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| Formula |
C19H19N5O2S
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| Molecular Weight |
381.461
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| Canonical SMILES |
Cc1cn(CCCNC(=O)c2ccc(O)c3nc([nH]c23)-c2cccs2)cn1
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| InChI |
InChI=1S/C19H19N5O2S/c1-12-10-24(11-21-12)8-3-7-20-19(26)13-5-6-14(25)17-16(13)22-18(23-17)15-4-2-9-27-15/h2,4-6,9-11,25H,3,7-8H2,1H3,(H,20,26)(H,22,23)
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| InChIKey |
LACCCLQSCUIPJP-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