General Information of the Compound
| Compound ID |
CP0914883
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| Compound Name |
4-(5-(4-Fluorophenyl)-2,3-dihydro-1H-inden-1-yl)pyridine Hydrochloride
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| Structure |
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| Formula |
C20H17ClFN
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| Molecular Weight |
325.814
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| Canonical SMILES |
Cl.Fc1ccc(-c2ccc3c(c2)CCC3c2ccncc2)cc1
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| InChI |
InChI=1S/C20H16FN.ClH/c21-18-5-1-14(2-6-18)16-3-7-20-17(13-16)4-8-19(20)15-9-11-22-12-10-15;/h1-3,5-7,9-13,19H,4,8H2;1H
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| InChIKey |
OLPCUEGEMPLTMM-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: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial