General Information of the Compound
| Compound ID |
CP0780612
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| Compound Name |
5-[3,4-Dihydro-2H-naphthalen-(1E)-ylidenemethyl]-1H-imidazole
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| Structure |
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| Formula |
C14H14N2
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| Molecular Weight |
210.28
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| Canonical SMILES |
C(=C1\CCCc2ccccc21)\c1c[nH]cn1
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| InChI |
InChI=1S/C14H14N2/c1-2-7-14-11(4-1)5-3-6-12(14)8-13-9-15-10-16-13/h1-2,4,7-10H,3,5-6H2,(H,15,16)/b12-8+
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| InChIKey |
LBBCKDMLQODDIG-XYOKQWHBSA-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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial