General Information of the Compound
| Compound ID |
CP0515270
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| Compound Name |
US9278960, 3-28
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| Structure |
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| Formula |
C20H14FN5O3
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| Molecular Weight |
391.362
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(Cn3cc(nn3)C(O)=O)cc2n1
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| InChI |
InChI=1S/C20H14FN5O3/c21-13-4-2-12(3-5-13)15-8-17(19(22)27)23-16-7-11(1-6-14(15)16)9-26-10-18(20(28)29)24-25-26/h1-8,10H,9H2,(H2,22,27)(H,28,29)
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| InChIKey |
ZZLYBXAWOCJNDA-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