General Information of the Compound
| Compound ID |
CP0373064
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| Compound Name |
1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[4-[(2-oxo-1H-pyrido[2,3-b]pyrazin-8-yl)oxy]naphthalen-1-yl]urea
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| Structure |
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| Formula |
C25H15F4N5O3
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| Molecular Weight |
509.419
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| Canonical SMILES |
Fc1ccc(cc1NC(=O)Nc1ccc(Oc2ccnc3ncc(=O)[nH]c23)c2ccccc12)C(F)(F)F
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| InChI |
InChI=1S/C25H15F4N5O3/c26-16-6-5-13(25(27,28)29)11-18(16)33-24(36)32-17-7-8-19(15-4-2-1-3-14(15)17)37-20-9-10-30-23-22(20)34-21(35)12-31-23/h1-12H,(H,34,35)(H2,32,33,36)
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| InChIKey |
BCIWUUZULNRCNE-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