General Information of the Compound
| Compound ID |
CP0507289
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| Compound Name |
2-[[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]methyl]-1-(2-methoxyethyl)benzimidazole
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| Structure |
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| Formula |
C19H23ClN6O
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| Molecular Weight |
386.887
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| Canonical SMILES |
COCCn1c(CN2CCN(CC2)c2ncc(Cl)cn2)nc2ccccc12
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| InChI |
InChI=1S/C19H23ClN6O/c1-27-11-10-26-17-5-3-2-4-16(17)23-18(26)14-24-6-8-25(9-7-24)19-21-12-15(20)13-22-19/h2-5,12-13H,6-11,14H2,1H3
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| InChIKey |
CVWSJJBPQWZTHO-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