General Information of the Compound
| Compound ID |
CP0400040
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| Compound Name |
4'-[6-(4-Hydroxy-cyclohexylmethyl)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]-biphenyl-4-ol
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| Structure |
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| Formula |
C28H27N3O2
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| Molecular Weight |
437.543
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| Canonical SMILES |
OC1CCN(Cc2ccc-3c(Cc4c(n[nH]c-34)-c3ccc(cc3)-c3ccc(O)cc3)c2)CC1
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| InChI |
InChI=1S/C28H27N3O2/c32-23-8-6-20(7-9-23)19-2-4-21(5-3-19)27-26-16-22-15-18(1-10-25(22)28(26)30-29-27)17-31-13-11-24(33)12-14-31/h1-10,15,24,32-33H,11-14,16-17H2,(H,29,30)
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| InChIKey |
CTVYVVBTBHTZBT-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