General Information of the Compound
| Compound ID |
CP0493680
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| Compound Name |
4-(1-butyl-6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol
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| Structure |
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| Formula |
C17H18N2O3
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| Molecular Weight |
298.342
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| Canonical SMILES |
CCCCn1nc(-c2ccc(O)cc2O)c2ccc(O)cc12
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| InChI |
InChI=1S/C17H18N2O3/c1-2-3-8-19-15-9-11(20)4-6-13(15)17(18-19)14-7-5-12(21)10-16(14)22/h4-7,9-10,20-22H,2-3,8H2,1H3
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| InChIKey |
HGZSLWUFOGHPTM-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