General Information of the Compound
| Compound ID |
CP0549068
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| Compound Name |
(3R)-1-(3-fluoren-9-ylidenepropyl)piperidine-3-carboxylic acid
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| Structure |
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| Formula |
C22H23NO2
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| Molecular Weight |
333.431
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| Canonical SMILES |
OC(=O)[C@@H]1CCCN(CCC=C2c3ccccc3-c3ccccc23)C1
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| InChI |
InChI=1S/C22H23NO2/c24-22(25)16-7-5-13-23(15-16)14-6-12-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-4,8-12,16H,5-7,13-15H2,(H,24,25)/t16-/m1/s1
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| InChIKey |
SJJUKGVRGZOKFH-MRXNPFEDSA-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