General Information of the Compound
| Compound ID |
CP0445905
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| Compound Name |
2-Amino-3-((3- bromophenyl) amino) benzofuran-6- carbonitrile
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| Structure |
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| Formula |
C15H10BrN3O
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| Molecular Weight |
328.169
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| Canonical SMILES |
Nc1oc2cc(ccc2c1Nc1cccc(Br)c1)C#N
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| InChI |
InChI=1S/C15H10BrN3O/c16-10-2-1-3-11(7-10)19-14-12-5-4-9(8-17)6-13(12)20-15(14)18/h1-7,19H,18H2
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| InChIKey |
JPHADCMFHNLEBX-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