General Information of the Compound
| Compound ID |
CP0499402
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| Compound Name |
1-[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]-N-methyl-N-[(4-phenoxyphenyl)methyl]methanamine
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| Structure |
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| Formula |
C24H29NO
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| Molecular Weight |
347.502
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| Canonical SMILES |
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C24H29NO/c1-24(2)20-12-11-19(23(24)15-20)17-25(3)16-18-9-13-22(14-10-18)26-21-7-5-4-6-8-21/h4-11,13-14,20,23H,12,15-17H2,1-3H3/t20-,23-/m0/s1
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| InChIKey |
NLMQXEACKGLLFE-REWPJTCUSA-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