General Information of the Compound
| Compound ID |
CP0504183
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| Compound Name |
N-[3-cyano-4-[3-[3-(diethylamino)pentanoylamino]phenyl]-6-(4-fluoro-2-hydroxyphenyl)pyridin-2-yl]furan-2-carboxamide
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| Structure |
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| Formula |
C32H32FN5O4
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| Molecular Weight |
569.637
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| Canonical SMILES |
CCC(CC(=O)Nc1cccc(c1)-c1cc(nc(NC(=O)c2ccco2)c1C#N)-c1ccc(F)cc1O)N(CC)CC
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| InChI |
InChI=1S/C32H32FN5O4/c1-4-23(38(5-2)6-3)17-30(40)35-22-10-7-9-20(15-22)25-18-27(24-13-12-21(33)16-28(24)39)36-31(26(25)19-34)37-32(41)29-11-8-14-42-29/h7-16,18,23,39H,4-6,17H2,1-3H3,(H,35,40)(H,36,37,41)
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| InChIKey |
BXTVJJPJKSYGAH-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