General Information of the Compound
| Compound ID |
CP0536227
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| Compound Name |
4-(2-Amino-3- ((3-chloro-4- fluorophenyl) amino)furo[2,3- c]pyridin-7-yl)- N-butyl- picolinamide
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| Structure |
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| Formula |
C23H21ClFN5O2
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| Molecular Weight |
453.905
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| Canonical SMILES |
CCCCNC(=O)c1cc(ccn1)-c1nccc2c(Nc3ccc(F)c(Cl)c3)c(N)oc12
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| InChI |
InChI=1S/C23H21ClFN5O2/c1-2-3-8-29-23(31)18-11-13(6-9-27-18)19-21-15(7-10-28-19)20(22(26)32-21)30-14-4-5-17(25)16(24)12-14/h4-7,9-12,30H,2-3,8,26H2,1H3,(H,29,31)
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| InChIKey |
TYVUBVANPGPHFM-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