General Information of the Compound
| Compound ID |
CP0514850
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| Compound Name |
4-amino-N-[6-chloro-3-[(2,5-difluorophenyl)sulfonylamino]-2-fluorophenyl]-6-methylquinazoline-8-carboxamide
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| Formula |
C22H15ClF3N5O3S
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| Molecular Weight |
521.908
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| Canonical SMILES |
Cc1cc(C(=O)Nc2c(Cl)ccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c2ncnc(N)c2c1
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| InChI |
InChI=1S/C22H15ClF3N5O3S/c1-10-6-12-19(28-9-29-21(12)27)13(7-10)22(32)30-20-14(23)3-5-16(18(20)26)31-35(33,34)17-8-11(24)2-4-15(17)25/h2-9,31H,1H3,(H,30,32)(H2,27,28,29)
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| InChIKey |
UNHNDJUQODCOFA-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