General Information of the Compound
| Compound ID |
CP0252211
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| Compound Name |
1-(3-amino-3-oxopropyl)-2-(4-bromobenzamido)-N-cyclohexyl-N-ethyl-1H-benzo[d]imidazole-5-carboxamide
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| Structure |
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| Formula |
C26H30BrN5O3
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| Molecular Weight |
540.462
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| Canonical SMILES |
CCN(C1CCCCC1)C(=O)c1ccc2n(CCC(N)=O)c(NC(=O)c3ccc(Br)cc3)nc2c1
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| InChI |
InChI=1S/C26H30BrN5O3/c1-2-31(20-6-4-3-5-7-20)25(35)18-10-13-22-21(16-18)29-26(32(22)15-14-23(28)33)30-24(34)17-8-11-19(27)12-9-17/h8-13,16,20H,2-7,14-15H2,1H3,(H2,28,33)(H,29,30,34)
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| InChIKey |
LMHXANVPOCTCND-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