General Information of the Compound
| Compound ID |
CP0545584
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| Compound Name |
2-[4-[(2-heptylbenzimidazol-1-yl)methyl]phenyl]benzamide
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| Structure |
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| Formula |
C28H31N3O
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| Molecular Weight |
425.576
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| Canonical SMILES |
CCCCCCCc1nc2ccccc2n1Cc1ccc(cc1)-c1ccccc1C(N)=O
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| InChI |
InChI=1S/C28H31N3O/c1-2-3-4-5-6-15-27-30-25-13-9-10-14-26(25)31(27)20-21-16-18-22(19-17-21)23-11-7-8-12-24(23)28(29)32/h7-14,16-19H,2-6,15,20H2,1H3,(H2,29,32)
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| InChIKey |
XWWHQZCOAQXCNH-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