General Information of the Compound
| Compound ID |
CP0386906
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| Compound Name |
3-(3-Hydroxyphenyl)-4-methyl-2-(4-(2-(3-methylazetidin-1-yl)ethoxy)phenyl)-2H-chromen-6-ol
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| Structure |
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| Formula |
C28H29NO4
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| Molecular Weight |
443.543
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| Canonical SMILES |
CC1CN(CCOc2ccc(cc2)C2Oc3ccc(O)cc3C(C)=C2c2cccc(O)c2)C1
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| InChI |
InChI=1S/C28H29NO4/c1-18-16-29(17-18)12-13-32-24-9-6-20(7-10-24)28-27(21-4-3-5-22(30)14-21)19(2)25-15-23(31)8-11-26(25)33-28/h3-11,14-15,18,28,30-31H,12-13,16-17H2,1-2H3
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| InChIKey |
ABKNJRSWPKAULO-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