General Information of the Compound
| Compound ID |
CP0573865
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| Compound Name |
4-amino-N-[6-chloro-3-[(2,5-difluorophenyl)sulfonylamino]-2-fluorophenyl]-6-(1,3-dimethylpyrazol-4-yl)quinazoline-8-carboxamide
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| Formula |
C26H19ClF3N7O3S
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| Molecular Weight |
601.998
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| Canonical SMILES |
Cc1nn(C)cc1-c1cc(C(=O)Nc2c(Cl)ccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c2ncnc(N)c2c1
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| InChI |
InChI=1S/C26H19ClF3N7O3S/c1-12-17(10-37(2)35-12)13-7-15-23(32-11-33-25(15)31)16(8-13)26(38)34-24-18(27)4-6-20(22(24)30)36-41(39,40)21-9-14(28)3-5-19(21)29/h3-11,36H,1-2H3,(H,34,38)(H2,31,32,33)
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| InChIKey |
AKKSYNYWRVMBOI-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