General Information of the Compound
| Compound ID |
CP0384985
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| Compound Name |
CHEMBL3781980
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| Formula |
C18H16N4O2
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| Molecular Weight |
320.352
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| Canonical SMILES |
Cc1ccc2nc([nH]c2c1)C1=C(N)N(CC1=O)c1cccc(O)c1
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| InChI |
InChI=1S/C18H16N4O2/c1-10-5-6-13-14(7-10)21-18(20-13)16-15(24)9-22(17(16)19)11-3-2-4-12(23)8-11/h2-8,23H,9,19H2,1H3,(H,20,21)
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| InChIKey |
GKDUYBVIKCSGHF-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