General Information of the Compound
| Compound ID |
CP0474122
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| Compound Name |
N-[4-(dimethylamino)phenyl]sulfonyl-N',4-diethyl-3,4-dihydropyrazole-2-carboximidamide
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| Structure |
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| Formula |
C16H25N5O2S
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| Molecular Weight |
351.476
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| Canonical SMILES |
CCN\C(=N/S(=O)(=O)c1ccc(cc1)N(C)C)N1CC(CC)C=N1
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| InChI |
InChI=1S/C16H25N5O2S/c1-5-13-11-18-21(12-13)16(17-6-2)19-24(22,23)15-9-7-14(8-10-15)20(3)4/h7-11,13H,5-6,12H2,1-4H3,(H,17,19)
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| InChIKey |
YBTPZELTNWNDBF-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