General Information of the Compound
| Compound ID |
CP0103098
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| Compound Name |
3-(4-{3-amino-7-[2-(morpholin-4-yl)ethoxy]-1,2-benzoxazol-4-yl}phenyl)-1-(2-fluoro-5-methylphenyl)urea
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| Structure |
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| Formula |
C27H28FN5O4
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| Molecular Weight |
505.55
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| Canonical SMILES |
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2ccc(OCCN3CCOCC3)c3onc(N)c23)c1
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| InChI |
InChI=1S/C27H28FN5O4/c1-17-2-8-21(28)22(16-17)31-27(34)30-19-5-3-18(4-6-19)20-7-9-23(25-24(20)26(29)32-37-25)36-15-12-33-10-13-35-14-11-33/h2-9,16H,10-15H2,1H3,(H2,29,32)(H2,30,31,34)
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| InChIKey |
YRDYSQQOGNXODJ-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