General Information of the Compound
| Compound ID |
CP0087145
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| Compound Name |
3-(cyclohexylmethyl)-5-[4-(2-hydroxypropan-2-yl)phenyl]-1H-imidazo[4,5-b]pyrazin-2-one
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| Structure |
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| Formula |
C21H26N4O2
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| Molecular Weight |
366.465
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| Canonical SMILES |
CC(C)(O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1
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| InChI |
InChI=1S/C21H26N4O2/c1-21(2,27)16-10-8-15(9-11-16)17-12-22-18-19(23-17)25(20(26)24-18)13-14-6-4-3-5-7-14/h8-12,14,27H,3-7,13H2,1-2H3,(H,22,24,26)
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| InChIKey |
BHPWHRPVZOWBAN-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