General Information of the Compound
| Compound ID |
CP0491335
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| Compound Name |
1-cyano-2-[6-[cyclohexyl(3-morpholin-4-ylpropyl)sulfamoyl]hexyl]-3-pyridin-4-ylguanidine
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| Structure |
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| Formula |
C26H43N7O3S
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| Molecular Weight |
533.743
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| Canonical SMILES |
O=S(=O)(CCCCCCNC(NC#N)=Nc1ccncc1)N(CCCN1CCOCC1)C1CCCCC1
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| InChI |
InChI=1S/C26H43N7O3S/c27-23-30-26(31-24-11-14-28-15-12-24)29-13-6-1-2-7-22-37(34,35)33(25-9-4-3-5-10-25)17-8-16-32-18-20-36-21-19-32/h11-12,14-15,25H,1-10,13,16-22H2,(H2,28,29,30,31)
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| InChIKey |
AWAHBFIOJHZMMK-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