General Information of the Compound
| Compound ID |
CP0538018
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| Compound Name |
4-bromo-1-(cyclohexylmethyl)benzotriazole
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| Structure |
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| Formula |
C13H16BrN3
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| Molecular Weight |
294.196
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| Canonical SMILES |
Brc1cccc2n(CC3CCCCC3)nnc12
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| InChI |
InChI=1S/C13H16BrN3/c14-11-7-4-8-12-13(11)15-16-17(12)9-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2
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| InChIKey |
USXIYITXGHEERF-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