General Information of the Compound
| Compound ID |
CP0204274
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| Compound Name |
6-(7-benzyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-yl)-4H-1,4-benzoxazin-3-one
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| Structure |
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| Formula |
C19H15N5O2S
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| Molecular Weight |
377.429
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| Canonical SMILES |
O=C1COc2ccc(cc2N1)C1=Nn2cnnc2SC1Cc1ccccc1
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| InChI |
InChI=1S/C19H15N5O2S/c25-17-10-26-15-7-6-13(9-14(15)21-17)18-16(8-12-4-2-1-3-5-12)27-19-22-20-11-24(19)23-18/h1-7,9,11,16H,8,10H2,(H,21,25)
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| InChIKey |
QQJNEPFCXZBMIV-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