General Information of the Compound
| Compound ID |
CP0412860
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| Compound Name |
2-[1-(1H-imidazol-2-yl)-2,3-dihydro-1H-inden-4-yl]-1,3-thiazole
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| Structure |
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| Formula |
C15H13N3S
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| Molecular Weight |
267.357
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| Canonical SMILES |
C1Cc2c(cccc2-c2nccs2)C1c1ncc[nH]1
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| InChI |
InChI=1S/C15H13N3S/c1-2-10-11(13(3-1)15-18-8-9-19-15)4-5-12(10)14-16-6-7-17-14/h1-3,6-9,12H,4-5H2,(H,16,17)
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| InChIKey |
CDJSNQBVAYXVIN-UHFFFAOYSA-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: PT01089, Alpha-1A adrenergic receptor
Protein ID: PT01007, Alpha-1B adrenergic receptor
Protein ID: PT01004, Alpha-1D adrenergic receptor
Protein ID: PT01650, Alpha-2A adrenergic receptor