General Information of the Compound
| Compound ID |
CP0742368
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| Compound Name |
12-phenyl-9-(trifluoromethyl)benzo[b]acridine hydrochloride
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| Structure |
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| Formula |
C24H15ClF3N
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| Molecular Weight |
409.838
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| Canonical SMILES |
Cl.FC(F)(F)c1ccc2cc3nc4ccccc4c(-c4ccccc4)c3cc2c1
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| InChI |
InChI=1S/C24H14F3N.ClH/c25-24(26,27)18-11-10-16-14-22-20(13-17(16)12-18)23(15-6-2-1-3-7-15)19-8-4-5-9-21(19)28-22;/h1-14H;1H
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| InChIKey |
DFIWCTLXYCCEKQ-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