General Information of the Compound
| Compound ID |
CP0153919
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| Compound Name |
2-(4-{3-[4-(4-Chloro-phenyl)-piperazin-1-yl]-propoxy}-phenyl)-1H-benzoimidazole
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| Structure |
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| Formula |
C26H27ClN4O
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| Molecular Weight |
446.982
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| Canonical SMILES |
Clc1ccc(cc1)N1CCN(CCCOc2ccc(cc2)-c2nc3ccccc3[nH]2)CC1
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| InChI |
InChI=1S/C26H27ClN4O/c27-21-8-10-22(11-9-21)31-17-15-30(16-18-31)14-3-19-32-23-12-6-20(7-13-23)26-28-24-4-1-2-5-25(24)29-26/h1-2,4-13H,3,14-19H2,(H,28,29)
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| InChIKey |
BMPOKXVXNLPKTD-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