General Information of the Compound
| Compound ID |
CP0430684
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| Compound Name |
benzyl 1-benzoyl-2-benzylpyrrolidine-2-carboxylate
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| Structure |
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| Formula |
C26H25NO3
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| Molecular Weight |
399.49
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| Canonical SMILES |
O=C(OCc1ccccc1)C1(Cc2ccccc2)CCCN1C(=O)c1ccccc1
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| InChI |
InChI=1S/C26H25NO3/c28-24(23-15-8-3-9-16-23)27-18-10-17-26(27,19-21-11-4-1-5-12-21)25(29)30-20-22-13-6-2-7-14-22/h1-9,11-16H,10,17-20H2
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| InChIKey |
CSOHPLLDZRUYES-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