General Information of the Compound
| Compound ID |
CP0476834
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| Compound Name |
1-(2,6-difluoro-4-(1-methyl-1H-pyrazol-4-yl)benzyl)-7-fluoroindoline-2,3-dione
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| Structure |
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| Formula |
C19H12F3N3O2
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| Molecular Weight |
371.318
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| Canonical SMILES |
Cn1cc(cn1)-c1cc(F)c(CN2C(=O)C(=O)c3cccc(F)c23)c(F)c1
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| InChI |
InChI=1S/C19H12F3N3O2/c1-24-8-11(7-23-24)10-5-15(21)13(16(22)6-10)9-25-17-12(18(26)19(25)27)3-2-4-14(17)20/h2-8H,9H2,1H3
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| InChIKey |
MHQPSTJMZXNOSA-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