General Information of the Compound
| Compound ID |
CP0363620
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| Compound Name |
2-[(4-ethoxyphenyl)methyl]-1-(3-methylbutyl)-N-[4-(1,2,3,4-tetrahydroacridin-9-ylamino)butyl]benzimidazole-5-carboxamide
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| Structure |
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| Formula |
C39H47N5O2
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| Molecular Weight |
617.838
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| Canonical SMILES |
CCOc1ccc(Cc2nc3cc(ccc3n2CCC(C)C)C(=O)NCCCCNc2c3CCCCc3nc3ccccc23)cc1
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| InChI |
InChI=1S/C39H47N5O2/c1-4-46-30-18-15-28(16-19-30)25-37-43-35-26-29(17-20-36(35)44(37)24-21-27(2)3)39(45)41-23-10-9-22-40-38-31-11-5-7-13-33(31)42-34-14-8-6-12-32(34)38/h5,7,11,13,15-20,26-27H,4,6,8-10,12,14,21-25H2,1-3H3,(H,40,42)(H,41,45)
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| InChIKey |
YWNNZVOAUVSVFF-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