General Information of the Compound
| Compound ID |
CP0517261
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| Compound Name |
1-cyano-2-[6-[cyclohexylmethoxy(2-fluoroethyl)sulfamoyl]hexyl]-3-pyridin-4-ylguanidine
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| Structure |
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| Formula |
C22H35FN6O3S
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| Molecular Weight |
482.626
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| Canonical SMILES |
FCCN(OCC1CCCCC1)S(=O)(=O)CCCCCCNC(NC#N)=Nc1ccncc1
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| InChI |
InChI=1S/C22H35FN6O3S/c23-12-16-29(32-18-20-8-4-3-5-9-20)33(30,31)17-7-2-1-6-13-26-22(27-19-24)28-21-10-14-25-15-11-21/h10-11,14-15,20H,1-9,12-13,16-18H2,(H2,25,26,27,28)
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| InChIKey |
FVPBIEOUUNHZLP-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