General Information of the Compound
| Compound ID |
CP0519602
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| Compound Name |
1-(diaminomethylidene)-2-(4-nitrophenyl)guanidine
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| Structure |
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| Formula |
C8H10N6O2
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| Molecular Weight |
222.208
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| Canonical SMILES |
NC(N)=N\C(N)=N\c1ccc(cc1)[N+]([O-])=O
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| InChI |
InChI=1S/C8H10N6O2/c9-7(10)13-8(11)12-5-1-3-6(4-2-5)14(15)16/h1-4H,(H6,9,10,11,12,13)
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| InChIKey |
BRGSYTBCYKKSBQ-UHFFFAOYSA-N
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| CAS |
4323-50-6
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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