General Information of the Compound
| Compound ID |
CP0004656
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| Compound Name |
3,5-diamino-N-(diaminomethylidene)-6-(2-methoxypyrimidin-5-yl)pyrazine-2-carboxamide
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| Structure |
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| Formula |
C11H13N9O2
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| Molecular Weight |
303.286
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| Canonical SMILES |
COc1ncc(cn1)-c1nc(C(=O)NC(N)=N)c(N)nc1N
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| InChI |
InChI=1S/C11H13N9O2/c1-22-11-16-2-4(3-17-11)5-7(12)19-8(13)6(18-5)9(21)20-10(14)15/h2-3H,1H3,(H4,12,13,19)(H4,14,15,20,21)
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| InChIKey |
XFGYFQDKMRBURI-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
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha