General Information of the Compound
| Compound ID |
CP0577854
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| Compound Name |
1-N-(3-methyloxetan-3-yl)-7-N-(3,4,5-trifluorophenyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1,7-dicarboxamide
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| Structure |
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| Formula |
C18H18F3N5O3
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| Molecular Weight |
409.368
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| Canonical SMILES |
CC1(COC1)NC(=O)c1ncn2CCN(Cc12)C(=O)Nc1cc(F)c(F)c(F)c1
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| InChI |
InChI=1S/C18H18F3N5O3/c1-18(7-29-8-18)24-16(27)15-13-6-25(2-3-26(13)9-22-15)17(28)23-10-4-11(19)14(21)12(20)5-10/h4-5,9H,2-3,6-8H2,1H3,(H,23,28)(H,24,27)
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| InChIKey |
SZDDYSUULLKXDH-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