General Information of the Compound
| Compound ID |
CP0879098
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| Compound Name |
(E)-1-(2-(2-((2'-chlorobiphenyl-2-yl)methylene)hydrazinyl)ethyl)piperidine-3-carboxylic acid
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| Structure |
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| Formula |
C21H24ClN3O2
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| Molecular Weight |
385.895
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| Canonical SMILES |
O=C(O)C1CCCN(CCN/N=C/c2ccccc2-c2ccccc2Cl)C1
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| InChI |
InChI=1S/C21H24ClN3O2/c22-20-10-4-3-9-19(20)18-8-2-1-6-16(18)14-24-23-11-13-25-12-5-7-17(15-25)21(26)27/h1-4,6,8-10,14,17,23H,5,7,11-13,15H2,(H,26,27)/b24-14+
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| InChIKey |
NWVSELWWRYDLAI-ZVHZXABRSA-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