General Information of the Compound
Compound ID |
CP0557638
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Compound Name |
US8575364, 60
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Structure |
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Formula |
C18H21N
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Molecular Weight |
251.373
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Canonical SMILES |
CN1CCC(C1)c1ccccc1-c1ccccc1C
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InChI |
InChI=1S/C18H21N/c1-14-7-3-4-8-16(14)18-10-6-5-9-17(18)15-11-12-19(2)13-15/h3-10,15H,11-13H2,1-2H3
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InChIKey |
FBKQBOIUAVUKOR-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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