General Information of the Compound
| Compound ID |
CP0255446
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| Compound Name |
6-Amino-1-(2-cyclopropylethyl)-3-(1,1-dioxo-1,4-dihydrobenzo[1,2,4]thiadiazin-3-
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| Structure |
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| Formula |
C21H20N4O4S
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| Molecular Weight |
424.482
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| Canonical SMILES |
Nc1ccc2n(CCC3CC3)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1
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| InChI |
InChI=1S/C21H20N4O4S/c22-13-7-8-16-14(11-13)19(26)18(21(27)25(16)10-9-12-5-6-12)20-23-15-3-1-2-4-17(15)30(28,29)24-20/h1-4,7-8,11-12,26H,5-6,9-10,22H2,(H,23,24)
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| InChIKey |
BVSNSEBXFBXOBP-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