General Information of the Compound
| Compound ID |
CP0459728
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| Compound Name |
3-carboxamido coumarin, 23
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| Structure |
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| Formula |
C17H12ClNO3
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| Molecular Weight |
313.74
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| Canonical SMILES |
Cc1cccc(Cl)c1NC(=O)c1cc2ccccc2oc1=O
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| InChI |
InChI=1S/C17H12ClNO3/c1-10-5-4-7-13(18)15(10)19-16(20)12-9-11-6-2-3-8-14(11)22-17(12)21/h2-9H,1H3,(H,19,20)
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| InChIKey |
KKQXITVOUUCVQH-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