General Information of the Compound
| Compound ID |
CP0502648
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| Compound Name |
2-[2-(2-Bromo-phenoxy)-ethylamino]-benzo[h]chromen-4-one
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| Structure |
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| Formula |
C21H16BrNO3
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| Molecular Weight |
410.267
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| Canonical SMILES |
Brc1ccccc1OCCNc1cc(=O)c2ccc3ccccc3c2o1
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| InChI |
InChI=1S/C21H16BrNO3/c22-17-7-3-4-8-19(17)25-12-11-23-20-13-18(24)16-10-9-14-5-1-2-6-15(14)21(16)26-20/h1-10,13,23H,11-12H2
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| InChIKey |
FNEVXZRSKAPXGS-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