General Information of the Compound
| Compound ID |
CP0520299
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| Compound Name |
US9163015, 45
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| Structure |
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| Formula |
C9H7N5S
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| Molecular Weight |
217.257
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| Canonical SMILES |
N(c1nccs1)c1n[nH]c2cccnc12
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| InChI |
InChI=1S/C9H7N5S/c1-2-6-7(10-3-1)8(14-13-6)12-9-11-4-5-15-9/h1-5H,(H2,11,12,13,14)
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| InChIKey |
UDQWWLXMUBQWGT-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