General Information of the Compound
| Compound ID |
CP0493528
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| Compound Name |
N-[(4-iodophenyl)methyl]-N-methyl-1-[(1S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]methanamine
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| Structure |
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| Formula |
C19H28IN
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| Molecular Weight |
397.344
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| Canonical SMILES |
CN(CC1C[C@H]2CC[C@]1(C)C2(C)C)Cc1ccc(I)cc1
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| InChI |
InChI=1S/C19H28IN/c1-18(2)15-9-10-19(18,3)16(11-15)13-21(4)12-14-5-7-17(20)8-6-14/h5-8,15-16H,9-13H2,1-4H3/t15-,16?,19+/m1/s1
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| InChIKey |
KNVBEUMTQORZCV-LQUOLJLFSA-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