General Information of the Compound
| Compound ID |
CP0847202
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| Compound Name |
rac-N-(2-(4-chlorophenyl)pyridin-3-yl)-1,3-dioxo-2-((1S,2R)-2-phenylcyclopropyl)hexahydroimidazo[1,5-a]pyrazine-7(1H)-carboxamide
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| Structure |
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| Formula |
C27H24ClN5O3
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| Molecular Weight |
501.974
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| Canonical SMILES |
O=C(Nc1cccnc1-c1ccc(Cl)cc1)N1CCN2C(=O)N([C@H]3C[C@@H]3c3ccccc3)C(=O)C2C1
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| InChI |
InChI=1S/C27H24ClN5O3/c28-19-10-8-18(9-11-19)24-21(7-4-12-29-24)30-26(35)31-13-14-32-23(16-31)25(34)33(27(32)36)22-15-20(22)17-5-2-1-3-6-17/h1-12,20,22-23H,13-16H2,(H,30,35)/t20-,22+,23?/m1/s1
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| InChIKey |
IMGAQUCILNZHKU-PTCKQWLISA-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