General Information of the Compound
| Compound ID |
CP0473761
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| Compound Name |
1-(2-(5-(furan-2-yl)-1-(4-methoxybenzyl)-4,6-dioxo-1,4,5,6-tetrahydro-1,3,5-triazin-2-ylamino)ethyl)guanidine
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| Structure |
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| Formula |
C18H21N7O4
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| Molecular Weight |
399.411
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| Canonical SMILES |
COc1ccc(Cn2c(NCCN=C(N)N)nc(=O)n(-c3ccco3)c2=O)cc1
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| InChI |
InChI=1S/C18H21N7O4/c1-28-13-6-4-12(5-7-13)11-24-16(22-9-8-21-15(19)20)23-17(26)25(18(24)27)14-3-2-10-29-14/h2-7,10H,8-9,11H2,1H3,(H4,19,20,21)(H,22,23,26)
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| InChIKey |
OMYSRCLBSSXZDE-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