General Information of the Compound
| Compound ID |
CP0571116
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| Compound Name |
3-benzamido-N-(1-hydroxy-3H-2,1-benzoxaborol-6-yl)benzamide
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| Structure |
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| Formula |
C21H17BN2O4
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| Molecular Weight |
372.189
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| Canonical SMILES |
OB1OCc2ccc(NC(=O)c3cccc(NC(=O)c4ccccc4)c3)cc12
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| InChI |
InChI=1S/C21H17BN2O4/c25-20(14-5-2-1-3-6-14)23-17-8-4-7-15(11-17)21(26)24-18-10-9-16-13-28-22(27)19(16)12-18/h1-12,27H,13H2,(H,23,25)(H,24,26)
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| InChIKey |
YAOZUINXYWQWRJ-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