General Information of the Compound
| Compound ID |
CP0650853
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| Compound Name |
(7R,8R)-8-(2,4,5-Trifluoro-phenyl)-6,7,8,9-tetrahydro-dipyrido[1,2-a3',4'-d]imidazol-7-ylamine tris hydrochloride
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| Structure |
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| Formula |
C16H14ClF3N4
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| Molecular Weight |
354.763
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| Canonical SMILES |
Cl.N[C@H]1Cn2c(nc3cnccc32)C[C@@H]1c1cc(F)c(F)cc1F
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| InChI |
InChI=1S/C16H13F3N4.ClH/c17-10-5-12(19)11(18)3-8(10)9-4-16-22-14-6-21-2-1-15(14)23(16)7-13(9)20;/h1-3,5-6,9,13H,4,7,20H2;1H/t9-,13+;/m1./s1
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| InChIKey |
TZWXUQQRGYTXLS-XVUIFDSFSA-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