General Information of the Compound
| Compound ID |
CP0421515
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| Compound Name |
(S)-1-(4,4-diphenylbut-3-enyl)pyrrolidine-2-carboxylic acid
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| Structure |
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| Formula |
C21H23NO2
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| Molecular Weight |
321.42
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| Canonical SMILES |
OC(=O)[C@@H]1CCCN1CCC=C(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C21H23NO2/c23-21(24)20-14-8-16-22(20)15-7-13-19(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-13,20H,7-8,14-16H2,(H,23,24)/t20-/m0/s1
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| InChIKey |
RYBCVAAJKUTVPY-FQEVSTJZSA-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