General Information of the Compound
| Compound ID |
CP0546811
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| Compound Name |
[1-(4-chlorophenyl)triazol-4-yl]methanol
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| Structure |
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| Formula |
C9H8ClN3O
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| Molecular Weight |
209.636
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| Canonical SMILES |
OCc1cn(nn1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C9H8ClN3O/c10-7-1-3-9(4-2-7)13-5-8(6-14)11-12-13/h1-5,14H,6H2
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| InChIKey |
CAHIFLPAMJOAGI-UHFFFAOYSA-N
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| CAS |
133902-66-6
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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