General Information of the Compound
| Compound ID |
CP0698094
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| Compound Name |
SID24417083
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| Structure |
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| Formula |
C11H10N4OS
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| Molecular Weight |
246.295
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| Canonical SMILES |
O=C(Nc1nnc2n1CCS2)c1ccccc1
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| InChI |
InChI=1S/C11H10N4OS/c16-9(8-4-2-1-3-5-8)12-10-13-14-11-15(10)6-7-17-11/h1-5H,6-7H2,(H,12,13,16)
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| InChIKey |
WHLPUDGCKVVGKE-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