General Information of the Compound
| Compound ID |
CP0381665
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| Compound Name |
N-[1-[(4-chloro-2-fluorophenyl)methyl]piperidin-4-yl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
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| Structure |
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| Formula |
C20H29ClFN3
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| Molecular Weight |
365.924
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| Canonical SMILES |
CN1C2CCC1CC(C2)NC1CCN(Cc2ccc(Cl)cc2F)CC1
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| InChI |
InChI=1S/C20H29ClFN3/c1-24-18-4-5-19(24)12-17(11-18)23-16-6-8-25(9-7-16)13-14-2-3-15(21)10-20(14)22/h2-3,10,16-19,23H,4-9,11-13H2,1H3
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| InChIKey |
FPGDJTQXXKYMSU-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