General Information of the Compound
| Compound ID |
CP0488170
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| Compound Name |
N-[[4-(3,4-dimethoxyphenyl)phenyl]methyl]-1-[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]-N-methylmethanamine
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| Structure |
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| Formula |
C26H33NO2
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| Molecular Weight |
391.555
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| Canonical SMILES |
COc1ccc(cc1OC)-c1ccc(CN(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1
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| InChI |
InChI=1S/C26H33NO2/c1-26(2)22-12-10-21(23(26)15-22)17-27(3)16-18-6-8-19(9-7-18)20-11-13-24(28-4)25(14-20)29-5/h6-11,13-14,22-23H,12,15-17H2,1-5H3/t22-,23-/m0/s1
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| InChIKey |
OFSPGJNTHAPQHA-GOTSBHOMSA-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