General Information of the Compound
| Compound ID |
CP0550644
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| Compound Name |
US9278960, 4-110
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| Structure |
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| Formula |
C24H25FN4O
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| Molecular Weight |
404.489
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| Canonical SMILES |
NC(=O)c1cc(-c2ccc(F)cc2)c2ccc(CN3CCNC(C3)C3CC3)cc2n1
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| InChI |
InChI=1S/C24H25FN4O/c25-18-6-4-16(5-7-18)20-12-22(24(26)30)28-21-11-15(1-8-19(20)21)13-29-10-9-27-23(14-29)17-2-3-17/h1,4-8,11-12,17,23,27H,2-3,9-10,13-14H2,(H2,26,30)
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| InChIKey |
RBHZPRAUKHDEPX-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