General Information of the Compound
| Compound ID |
CP0767945
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| Compound Name |
5-Indan-(1E)-ylidenemethyl-1H-imidazole
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| Synonyms |
5-Indan-(1E)-ylidenemethyl-1H-imidazole
5-[(E)-2,3-Dihydro-1H-inden-1-ylidenemethyl]-1H-imidazole
5-[(E)-2,3-dihydroinden-1-ylidenemethyl]-1H-imidazole
AC1O70GB
BDBM8873
CHEMBL177468
Imidazolylmethyleneindane 2a
SCHEMBL13877092
SCHEMBL4235335
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| Structure |
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| Formula |
C13H12N2
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| Molecular Weight |
196.253
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| Canonical SMILES |
C(=C1\CCc2ccccc21)\c1c[nH]cn1
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| InChI |
InChI=1S/C13H12N2/c1-2-4-13-10(3-1)5-6-11(13)7-12-8-14-9-15-12/h1-4,7-9H,5-6H2,(H,14,15)/b11-7+
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| InChIKey |
FXLOWXDBTSZJFZ-YRNVUSSQSA-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
Clinical Information about the Compound