General Information of the Compound
| Compound ID |
CP0315928
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| Compound Name |
N,N-dimethyl-4-[4-(1-methylsulfonylcyclopropyl)-6-morpholin-4-ylpyrimidin-2-yl]-1H-indole-6-carboxamide
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| Structure |
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| Formula |
C23H27N5O4S
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| Molecular Weight |
469.567
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| Canonical SMILES |
CN(C)C(=O)c1cc(-c2nc(cc(n2)C2(CC2)S(C)(=O)=O)N2CCOCC2)c2cc[nH]c2c1
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| InChI |
InChI=1S/C23H27N5O4S/c1-27(2)22(29)15-12-17(16-4-7-24-18(16)13-15)21-25-19(23(5-6-23)33(3,30)31)14-20(26-21)28-8-10-32-11-9-28/h4,7,12-14,24H,5-6,8-11H2,1-3H3
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| InChIKey |
BFDPMSKSQADYCT-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