General Information of the Compound
| Compound ID |
CP0375361
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| Compound Name |
1-pentylbenzimidazole-2,4-diamine
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| Structure |
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| Formula |
C12H18N4
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| Molecular Weight |
218.304
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| Canonical SMILES |
CCCCCn1c(N)nc2c(N)cccc12
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| InChI |
InChI=1S/C12H18N4/c1-2-3-4-8-16-10-7-5-6-9(13)11(10)15-12(16)14/h5-7H,2-4,8,13H2,1H3,(H2,14,15)
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| InChIKey |
RSUQBVCZDZWGIK-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