General Information of the Compound
| Compound ID |
CP0887656
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| Compound Name |
(S)-1,3-dioxo-2-((1S,2R)-2-phenylcyclopropyl)-N-(2-phenylpyridin-3-yl)hexahydroimidazo[1,5-a]pyrazine-7(1H)-carboxamide
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| Structure |
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| Formula |
C27H25N5O3
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| Molecular Weight |
467.529
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| Canonical SMILES |
O=C(Nc1cccnc1-c1ccccc1)N1CCN2C(=O)N([C@H]3C[C@@H]3c3ccccc3)C(=O)[C@@H]2C1
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| InChI |
InChI=1S/C27H25N5O3/c33-25-23-17-30(26(34)29-21-12-7-13-28-24(21)19-10-5-2-6-11-19)14-15-31(23)27(35)32(25)22-16-20(22)18-8-3-1-4-9-18/h1-13,20,22-23H,14-17H2,(H,29,34)/t20-,22+,23+/m1/s1
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| InChIKey |
KTUAMYOQSDFRNT-PUHATCMVSA-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