General Information of the Compound
| Compound ID |
CP0539988
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| Compound Name |
US10227343, Example 83
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| Structure |
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| Formula |
C15H11N5
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| Molecular Weight |
261.288
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| Canonical SMILES |
N(c1n[nH]c2cccnc12)c1cnc2ccccc2c1
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| InChI |
InChI=1S/C15H11N5/c1-2-5-12-10(4-1)8-11(9-17-12)18-15-14-13(19-20-15)6-3-7-16-14/h1-9H,(H2,18,19,20)
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| InChIKey |
CVJFMFGKTFDXQX-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