General Information of the Compound
| Compound ID |
CP0543777
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| Compound Name |
2-chloro-N-(3-{5-[(2-chlorobenzene)amido]-1H-1,3-benzodiazol-2-yl}phenyl)benzamide
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| Structure |
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| Formula |
C27H18Cl2N4O2
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| Molecular Weight |
501.373
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| Canonical SMILES |
Clc1ccccc1C(=O)Nc1cccc(c1)-c1nc2ccc(NC(=O)c3ccccc3Cl)cc2[nH]1
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| InChI |
InChI=1S/C27H18Cl2N4O2/c28-21-10-3-1-8-19(21)26(34)30-17-7-5-6-16(14-17)25-32-23-13-12-18(15-24(23)33-25)31-27(35)20-9-2-4-11-22(20)29/h1-15H,(H,30,34)(H,31,35)(H,32,33)
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| InChIKey |
SNNVALFLYQXYNU-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