General Information of the Compound
| Compound ID |
CP0479670
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| Compound Name |
US9278960, 4-50
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| Structure |
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| Formula |
C22H23FN4O
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| Molecular Weight |
378.451
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| Canonical SMILES |
NC1CCN(Cc2ccc3c(cc(nc3c2)C(N)=O)-c2ccc(F)cc2)CC1
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| InChI |
InChI=1S/C22H23FN4O/c23-16-4-2-15(3-5-16)19-12-21(22(25)28)26-20-11-14(1-6-18(19)20)13-27-9-7-17(24)8-10-27/h1-6,11-12,17H,7-10,13,24H2,(H2,25,28)
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| InChIKey |
NPWSGCCVHIYDTM-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