General Information of the Compound
| Compound ID |
CP0209175
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| Compound Name |
(3E)-3-(pyridin-2-ylmethylidene)chromen-4-one
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| Structure |
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| Formula |
C15H11NO2
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| Molecular Weight |
237.258
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| Canonical SMILES |
O=C1\C(COc2ccccc12)=C\c1ccccn1
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| InChI |
InChI=1S/C15H11NO2/c17-15-11(9-12-5-3-4-8-16-12)10-18-14-7-2-1-6-13(14)15/h1-9H,10H2/b11-9+
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| InChIKey |
DUDLXRUHPVUQFY-PKNBQFBNSA-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
Protein ID: PT01362, Amine oxidase [flavin-containing] B
Protein ID: PT06109, Geminin