General Information of the Compound
| Compound ID |
CP0510269
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| Compound Name |
1-(3-Thiazol-2-yl-phenyl)-[1,2,4]triazinan-3-one
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| Structure |
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| Formula |
C12H12N4OS
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| Molecular Weight |
260.322
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| Canonical SMILES |
O=C1NCCN(N1)c1cccc(c1)-c1nccs1
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| InChI |
InChI=1S/C12H12N4OS/c17-12-14-4-6-16(15-12)10-3-1-2-9(8-10)11-13-5-7-18-11/h1-3,5,7-8H,4,6H2,(H2,14,15,17)
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| InChIKey |
SKOVZCGQUNIYPZ-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