General Information of the Compound
| Compound ID |
CP0423492
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| Compound Name |
CHEMBL4865666
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| Formula |
C17H13N3O2
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| Molecular Weight |
291.31
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| Canonical SMILES |
Cc1cc(=O)n2nc(c(-c3ccco3)c2[nH]1)-c1ccccc1
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| InChI |
InChI=1S/C17H13N3O2/c1-11-10-14(21)20-17(18-11)15(13-8-5-9-22-13)16(19-20)12-6-3-2-4-7-12/h2-10,18H,1H3
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| InChIKey |
MYSGPPTYCZUOIA-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