General Information of the Compound
| Compound ID |
CP0568516
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| Compound Name |
4-amino-N-[6-chloro-3-[(2,5-difluorophenyl)sulfonylamino]-2-fluorophenyl]-6-(1H-pyrazol-4-yl)quinazoline-8-carboxamide
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| Formula |
C24H15ClF3N7O3S
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| Molecular Weight |
573.944
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| Canonical SMILES |
Nc1ncnc2c(cc(cc12)-c1cn[nH]c1)C(=O)Nc1c(Cl)ccc(NS(=O)(=O)c2cc(F)ccc2F)c1F
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| InChI |
InChI=1S/C24H15ClF3N7O3S/c25-16-2-4-18(35-39(37,38)19-7-13(26)1-3-17(19)27)20(28)22(16)34-24(36)15-6-11(12-8-32-33-9-12)5-14-21(15)30-10-31-23(14)29/h1-10,35H,(H,32,33)(H,34,36)(H2,29,30,31)
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| InChIKey |
BXGNDUJPMMMICQ-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