General Information of the Compound
| Compound ID |
CP0444215
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| Compound Name |
1-[N'-[3-(2-amino-4-methyl-1,3-thiazol-5-yl)propyl]carbamimidoyl]-3-propylurea
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| Formula |
C12H22N6OS
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| Molecular Weight |
298.416
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| Canonical SMILES |
CCCNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
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| InChI |
InChI=1S/C12H22N6OS/c1-3-6-16-12(19)18-10(13)15-7-4-5-9-8(2)17-11(14)20-9/h3-7H2,1-2H3,(H2,14,17)(H4,13,15,16,18,19)
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| InChIKey |
WPXMCQSKYJYGHB-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