General Information of the Compound
| Compound ID |
CP0949926
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| Compound Name |
{4-bromo-2-[(quinolin-8-ylhydrazono)methyl]phenoxy}acetic acid
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| Structure |
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| Formula |
C18H14BrN3O3
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| Molecular Weight |
400.232
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| Canonical SMILES |
O=C(O)COc1ccc(Br)cc1/C=N/Nc1cccc2cccnc12
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| InChI |
InChI=1S/C18H14BrN3O3/c19-14-6-7-16(25-11-17(23)24)13(9-14)10-21-22-15-5-1-3-12-4-2-8-20-18(12)15/h1-10,22H,11H2,(H,23,24)/b21-10+
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| InChIKey |
BSYBZDOJJOFUQO-UFFVCSGVSA-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