General Information of the Compound
| Compound ID |
CP0560713
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| Compound Name |
US9278960, 4-36
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| Structure |
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| Formula |
C22H21FN4O3
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| Molecular Weight |
408.433
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| Canonical SMILES |
NC(=O)C1CC(O)CN1Cc1ccc2c(cc(nc2c1)C(N)=O)-c1ccc(F)cc1
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| InChI |
InChI=1S/C22H21FN4O3/c23-14-4-2-13(3-5-14)17-9-19(21(24)29)26-18-7-12(1-6-16(17)18)10-27-11-15(28)8-20(27)22(25)30/h1-7,9,15,20,28H,8,10-11H2,(H2,24,29)(H2,25,30)
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| InChIKey |
KMNIFQAGTKOYRD-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