General Information of the Compound
| Compound ID |
CP0422254
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| Compound Name |
N-[2-(3,4-dichlorophenyl)-4-[3-(2-oxo-3H-benzimidazol-1-yl)pyrrolidin-1-yl]butyl]-N-methylbenzamide
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| Structure |
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| Formula |
C29H30Cl2N4O2
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| Molecular Weight |
537.491
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| Canonical SMILES |
CN(CC(CCN1CCC(C1)n1c2ccccc2[nH]c1=O)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C29H30Cl2N4O2/c1-33(28(36)20-7-3-2-4-8-20)18-22(21-11-12-24(30)25(31)17-21)13-15-34-16-14-23(19-34)35-27-10-6-5-9-26(27)32-29(35)37/h2-12,17,22-23H,13-16,18-19H2,1H3,(H,32,37)
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| InChIKey |
FPXIRXAXVYUYRD-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