General Information of the Compound
| Compound ID |
CP0510048
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| Compound Name |
1-[(4-chloro-2-fluorophenyl)methyl]-N-[(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)methyl]piperidin-4-amine
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| Structure |
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| Formula |
C22H30ClFN2
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| Molecular Weight |
376.947
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| Canonical SMILES |
CC1(C)C2CC1C(CNC1CCN(Cc3ccc(Cl)cc3F)CC1)=CC2
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| InChI |
InChI=1S/C22H30ClFN2/c1-22(2)17-5-3-15(20(22)11-17)13-25-19-7-9-26(10-8-19)14-16-4-6-18(23)12-21(16)24/h3-4,6,12,17,19-20,25H,5,7-11,13-14H2,1-2H3
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| InChIKey |
KDBSMYAJFIQLSS-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