General Information of the Compound
| Compound ID |
CP0128841
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| Compound Name |
4-(4-thiophen-2-ylsulfonyl-1-piperazinyl)phenol
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| Structure |
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| Formula |
C14H16N2O3S2
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| Molecular Weight |
324.427
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| Canonical SMILES |
Oc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cccs1
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| InChI |
InChI=1S/C14H16N2O3S2/c17-13-5-3-12(4-6-13)15-7-9-16(10-8-15)21(18,19)14-2-1-11-20-14/h1-6,11,17H,7-10H2
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| InChIKey |
AMAVAQLCDDYRMN-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
Protein ID: PT06109, Geminin
Protein ID: PT01214, Tyrosine-protein kinase JAK2