General Information of the Compound
| Compound ID |
CP0438744
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| Compound Name |
N-[4-[3-[(2-aminoacetyl)amino]phenyl]-3-cyano-6-(4-fluoro-2-hydroxyphenyl)pyridin-2-yl]furan-2-carboxamide
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| Structure |
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| Formula |
C25H18FN5O4
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| Molecular Weight |
471.448
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| Canonical SMILES |
NCC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O
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| InChI |
InChI=1S/C25H18FN5O4/c26-15-6-7-17(21(32)10-15)20-11-18(14-3-1-4-16(9-14)29-23(33)13-28)19(12-27)24(30-20)31-25(34)22-5-2-8-35-22/h1-11,32H,13,28H2,(H,29,33)(H,30,31,34)
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| InChIKey |
QJBMUFWUQHPPBB-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