General Information of the Compound
| Compound ID |
CP0292752
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| Compound Name |
N-[5-[[3-(4-amino-6-methyl-1,3,5-triazin-2-yl)-5-(morpholin-4-ylmethyl)pyridin-2-yl]amino]-2-chloropyridin-3-yl]methanesulfonamide
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| Structure |
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| Formula |
C20H24ClN9O3S
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| Molecular Weight |
505.992
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| Canonical SMILES |
Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
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| InChI |
InChI=1S/C20H24ClN9O3S/c1-12-25-19(28-20(22)26-12)15-7-13(11-30-3-5-33-6-4-30)9-24-18(15)27-14-8-16(17(21)23-10-14)29-34(2,31)32/h7-10,29H,3-6,11H2,1-2H3,(H,24,27)(H2,22,25,26,28)
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| InChIKey |
GNMXQROCYSRVEQ-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