General Information of the Compound
| Compound ID |
CP0553354
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| Compound Name |
5-fluoro-N-methyl-4-[1-[4-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridin-6-yl]-2,3-dihydro-1H-inden-1-amine
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| Formula |
C27H29FN6
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| Molecular Weight |
456.569
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| Canonical SMILES |
CNC1CCc2c1ccc(F)c2-c1cc2n(ncc2cn1)-c1ccc(cc1)N1CCN(C)CC1
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| InChI |
InChI=1S/C27H29FN6/c1-29-24-10-8-22-21(24)7-9-23(28)27(22)25-15-26-18(16-30-25)17-31-34(26)20-5-3-19(4-6-20)33-13-11-32(2)12-14-33/h3-7,9,15-17,24,29H,8,10-14H2,1-2H3
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| InChIKey |
WQBSXHDOERWCRQ-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