General Information of the Compound
| Compound ID |
CP0903903
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| Compound Name |
rac-N-(2,3-dichloro-4-fluorophenyl)-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 |
C22H19Cl2FN4O3
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| Molecular Weight |
477.323
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| Canonical SMILES |
O=C(Nc1ccc(F)c(Cl)c1Cl)N1CCN2C(=O)N([C@H]3C[C@@H]3c3ccccc3)C(=O)C2C1
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| InChI |
InChI=1S/C22H19Cl2FN4O3/c23-18-14(25)6-7-15(19(18)24)26-21(31)27-8-9-28-17(11-27)20(30)29(22(28)32)16-10-13(16)12-4-2-1-3-5-12/h1-7,13,16-17H,8-11H2,(H,26,31)/t13-,16+,17?/m1/s1
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| InChIKey |
PASLDAQRXDKKSI-WBTZKQGOSA-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