General Information of the Compound
| Compound ID |
CP0472091
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| Compound Name |
3-[6-(furan-3-yl)benzotriazol-1-yl]phenol
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| Structure |
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| Formula |
C16H11N3O2
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| Molecular Weight |
277.283
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| Canonical SMILES |
Oc1cccc(c1)-n1nnc2ccc(cc12)-c1ccoc1
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| InChI |
InChI=1S/C16H11N3O2/c20-14-3-1-2-13(9-14)19-16-8-11(12-6-7-21-10-12)4-5-15(16)17-18-19/h1-10,20H
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| InChIKey |
LYUARLRTJOSQBJ-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