General Information of the Compound
| Compound ID |
CP0853823
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| Compound Name |
3-(4-(2-(Pyrrolidin-1-yl)ethoxy)phenyl)-2,5-bis(4-hydroxylphenyl)selenophene
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| Structure |
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| Formula |
C28H27NO3Se
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| Molecular Weight |
504.488
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| Canonical SMILES |
Oc1ccc(-c2cc(-c3ccc(OCCN4CCCC4)cc3)c(-c3ccc(O)cc3)[se]2)cc1
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| InChI |
InChI=1S/C28H27NO3Se/c30-23-9-3-21(4-10-23)27-19-26(28(33-27)22-5-11-24(31)12-6-22)20-7-13-25(14-8-20)32-18-17-29-15-1-2-16-29/h3-14,19,30-31H,1-2,15-18H2
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| InChIKey |
VVVLGMPSMDVQSS-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