General Information of the Compound
| Compound ID |
CP0315810
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| Compound Name |
7-fluoro-3-[3-(5-fluoropyridin-3-yl)phenyl]-3-pyridin-4-ylisoindol-1-amine
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| Structure |
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| Formula |
C24H16F2N4
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| Molecular Weight |
398.416
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| Canonical SMILES |
NC1=NC(c2cccc(F)c12)(c1ccncc1)c1cccc(c1)-c1cncc(F)c1
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| InChI |
InChI=1S/C24H16F2N4/c25-19-12-16(13-29-14-19)15-3-1-4-18(11-15)24(17-7-9-28-10-8-17)20-5-2-6-21(26)22(20)23(27)30-24/h1-14H,(H2,27,30)
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| InChIKey |
HLWMPHXAKRXVIS-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