General Information of the Compound
| Compound ID |
CP0093391
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| Compound Name |
N-[5-[[3-(4-amino-6-methyl-1,3,5-triazin-2-yl)pyridin-2-yl]amino]-2-chloropyridin-3-yl]morpholine-4-sulfonamide
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| Structure |
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| Formula |
C18H20ClN9O3S
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| Molecular Weight |
477.938
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| Canonical SMILES |
Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)N2CCOCC2)c1
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| InChI |
InChI=1S/C18H20ClN9O3S/c1-11-23-17(26-18(20)24-11)13-3-2-4-21-16(13)25-12-9-14(15(19)22-10-12)27-32(29,30)28-5-7-31-8-6-28/h2-4,9-10,27H,5-8H2,1H3,(H,21,25)(H2,20,23,24,26)
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| InChIKey |
AZUIZZBFQBKTCG-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