General Information of the Compound
| Compound ID |
CP0559033
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| Compound Name |
4-[2-[(3-methyl-4,5,6,7-tetrahydroindazol-1-yl)methyl]benzimidazol-1-yl]butan-1-ol
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| Structure |
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| Formula |
C20H26N4O
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| Molecular Weight |
338.455
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| Canonical SMILES |
Cc1nn(Cc2nc3ccccc3n2CCCCO)c2CCCCc12
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| InChI |
InChI=1S/C20H26N4O/c1-15-16-8-2-4-10-18(16)24(22-15)14-20-21-17-9-3-5-11-19(17)23(20)12-6-7-13-25/h3,5,9,11,25H,2,4,6-8,10,12-14H2,1H3
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| InChIKey |
URCIVYHWXZHGQF-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