General Information of the Compound
| Compound ID |
CP0541047
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| Compound Name |
Type I progenitor, 4
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| Structure |
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| Formula |
C12H8N4O3
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| Molecular Weight |
256.221
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| Canonical SMILES |
O=N(=O)c1ccc(Oc2ncnc3[nH]ccc23)cc1
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| InChI |
InChI=1S/C12H8N4O3/c17-16(18)8-1-3-9(4-2-8)19-12-10-5-6-13-11(10)14-7-15-12/h1-7H,(H,13,14,15)
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| InChIKey |
WXZFHBYLFDGWMH-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