General Information of the Compound
| Compound ID |
CP0534969
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| Compound Name |
6-(2-fluoro-6-methoxyphenyl)-1-[6-(4-methylpiperazin-1-yl)pyridin-2-yl]indazole-5-carbonitrile
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| Formula |
C25H23FN6O
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| Molecular Weight |
442.498
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| Canonical SMILES |
COc1cccc(F)c1-c1cc2n(ncc2cc1C#N)-c1cccc(n1)N1CCN(C)CC1
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| InChI |
InChI=1S/C25H23FN6O/c1-30-9-11-31(12-10-30)23-7-4-8-24(29-23)32-21-14-19(17(15-27)13-18(21)16-28-32)25-20(26)5-3-6-22(25)33-2/h3-8,13-14,16H,9-12H2,1-2H3
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| InChIKey |
BEABCZGDGKSOBY-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