General Information of the Compound
| Compound ID |
CP0508542
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| Compound Name |
2-[2-(4-methoxyphenyl)-6,6-dimethyl-1-phenyl-5,7-dihydropyrrolizin-3-yl]acetic acid
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| Structure |
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| Formula |
C24H25NO3
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| Molecular Weight |
375.468
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| Canonical SMILES |
COc1ccc(cc1)-c1c(CC(O)=O)n2CC(C)(C)Cc2c1-c1ccccc1
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| InChI |
InChI=1S/C24H25NO3/c1-24(2)14-20-23(16-7-5-4-6-8-16)22(17-9-11-18(28-3)12-10-17)19(13-21(26)27)25(20)15-24/h4-12H,13-15H2,1-3H3,(H,26,27)
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| InChIKey |
AUVPDYMSBDSCCS-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