General Information of the Compound
| Compound ID |
CP0137845
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| Compound Name |
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
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| Structure |
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| Formula |
C20H20N2O4
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| Molecular Weight |
352.39
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| Canonical SMILES |
Cc1ccc(cc1NC(=O)c1ccc2OCCOc2c1)C(=O)NC1CC1
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| InChI |
InChI=1S/C20H20N2O4/c1-12-2-3-13(19(23)21-15-5-6-15)10-16(12)22-20(24)14-4-7-17-18(11-14)26-9-8-25-17/h2-4,7,10-11,15H,5-6,8-9H2,1H3,(H,21,23)(H,22,24)
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| InChIKey |
FGLYGGSDDZXQHU-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