General Information of the Compound
| Compound ID |
CP0445526
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| Compound Name |
N-[(2-chlorophenyl)methyl]-2-[(9R)-9-pyridin-2-yl-6-oxaspiro[4.5]decan-9-yl]ethanamine
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| Structure |
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| Formula |
C23H29ClN2O
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| Molecular Weight |
384.951
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| Canonical SMILES |
Clc1ccccc1CNCC[C@]1(CCOC2(CCCC2)C1)c1ccccn1
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| InChI |
InChI=1S/C23H29ClN2O/c24-20-8-2-1-7-19(20)17-25-15-12-22(21-9-3-6-14-26-21)13-16-27-23(18-22)10-4-5-11-23/h1-3,6-9,14,25H,4-5,10-13,15-18H2/t22-/m1/s1
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| InChIKey |
SSGWYKGZPWBEGP-JOCHJYFZSA-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