General Information of the Compound
| Compound ID |
CP0465051
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| Compound Name |
2-[6,6-dimethyl-2-(4-phenoxyphenyl)-1-phenyl-5,7-dihydropyrrolizin-3-yl]acetic acid
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| Structure |
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| Formula |
C29H27NO3
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| Molecular Weight |
437.539
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| Canonical SMILES |
CC1(C)Cc2c(c(c(CC(O)=O)n2C1)-c1ccc(Oc2ccccc2)cc1)-c1ccccc1
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| InChI |
InChI=1S/C29H27NO3/c1-29(2)18-25-28(20-9-5-3-6-10-20)27(24(17-26(31)32)30(25)19-29)21-13-15-23(16-14-21)33-22-11-7-4-8-12-22/h3-16H,17-19H2,1-2H3,(H,31,32)
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| InChIKey |
DIZUKZAJBYVZEK-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