General Information of the Compound
| Compound ID |
CP0423270
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| Compound Name |
4-[(4-hydroxyphenyl)(1H-1,2,4-triazol-1-yl)methyl]phenol
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| Structure |
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| Formula |
C15H13N3O2
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| Molecular Weight |
267.288
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| Canonical SMILES |
Oc1ccc(cc1)C(c1ccc(O)cc1)n1cncn1
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| InChI |
InChI=1S/C15H13N3O2/c19-13-5-1-11(2-6-13)15(18-10-16-9-17-18)12-3-7-14(20)8-4-12/h1-10,15,19-20H
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| InChIKey |
AGSUQRPIHMSTHE-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