General Information of the Compound
| Compound ID |
CP0318746
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| Compound Name |
2-[[4-cyclopropyl-5-[1-(oxetan-3-yl)piperidin-4-yl]-1,3-thiazol-2-yl]amino]pyridine-4-carbonitrile
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| Structure |
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| Formula |
C20H23N5OS
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| Molecular Weight |
381.505
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| Canonical SMILES |
N#Cc1ccnc(Nc2nc(C3CC3)c(s2)C2CCN(CC2)C2COC2)c1
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| InChI |
InChI=1S/C20H23N5OS/c21-10-13-3-6-22-17(9-13)23-20-24-18(14-1-2-14)19(27-20)15-4-7-25(8-5-15)16-11-26-12-16/h3,6,9,14-16H,1-2,4-5,7-8,11-12H2,(H,22,23,24)
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| InChIKey |
ZDBCVOUBHOHGIX-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