General Information of the Compound
| Compound ID |
CP0909990
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| Compound Name |
3-cyano-6-(cyclopropylamino)-5-(4-(2,4-difluorobenzyl)piperazin-1-yl)-N,N-dimethylpyraZine-2-carboxamide
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| Structure |
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| Formula |
C21H23F2N7O2
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| Molecular Weight |
443.458
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| Canonical SMILES |
CN(C)C(=O)c1nc(NC2CC2)c(N2CCN(Oc3ccc(F)cc3F)CC2)nc1C#N
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| InChI |
InChI=1S/C21H23F2N7O2/c1-28(2)21(31)18-16(12-24)26-20(19(27-18)25-14-4-5-14)29-7-9-30(10-8-29)32-17-6-3-13(22)11-15(17)23/h3,6,11,14H,4-5,7-10H2,1-2H3,(H,25,27)
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| InChIKey |
RUFDKYDBKVWSDE-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