General Information of the Compound
| Compound ID |
CP0509134
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| Compound Name |
2-(diaminomethylideneamino)ethyl ethanimidothioate
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| Structure |
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| Formula |
C5H12N4S
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| Molecular Weight |
160.246
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| Canonical SMILES |
CC(=N)SCCNC(N)=N
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| InChI |
InChI=1S/C5H12N4S/c1-4(6)10-3-2-9-5(7)8/h6H,2-3H2,1H3,(H4,7,8,9)
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| InChIKey |
NNODRXXATJOAOG-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: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor