General Information of the Compound
| Compound ID |
CP0152018
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| Compound Name |
2-(6-(4-tert-butylphenyl)-2,2-dimethyl-7-phenyl-2,3-dihydro-1H-pyrrolizin-5-yl)acetic acid
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| Structure |
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| Formula |
C27H31NO2
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| Molecular Weight |
401.55
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)-c1c(CC(O)=O)n2CC(C)(C)Cc2c1-c1ccccc1
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| InChI |
InChI=1S/C27H31NO2/c1-26(2,3)20-13-11-19(12-14-20)24-21(15-23(29)30)28-17-27(4,5)16-22(28)25(24)18-9-7-6-8-10-18/h6-14H,15-17H2,1-5H3,(H,29,30)
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| InChIKey |
JCSNFRFQFGSHIF-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