General Information of the Compound
| Compound ID |
CP0572981
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| Compound Name |
2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]oxypyrazine
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| Structure |
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| Formula |
C14H19N5O3S
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| Molecular Weight |
337.405
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| Canonical SMILES |
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(CC1)Oc1cnccn1
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| InChI |
InChI=1S/C14H19N5O3S/c1-10-14(11(2)18-17-10)23(20,21)19-7-3-12(4-8-19)22-13-9-15-5-6-16-13/h5-6,9,12H,3-4,7-8H2,1-2H3,(H,17,18)
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| InChIKey |
DZBBKHCVWLMNTN-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