General Information of the Compound
| Compound ID |
CP0372210
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| Compound Name |
(8-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyrazin-2-yl)(4-(6-methylpyridin-2-yl)-1,4-diazepan-1-yl)methanone
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| Structure |
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| Formula |
C23H30N8O
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| Molecular Weight |
434.548
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| Canonical SMILES |
CN1CCN(CC1)c1nccn2cc(nc12)C(=O)N1CCCN(CC1)c1cccc(C)n1
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| InChI |
InChI=1S/C23H30N8O/c1-18-5-3-6-20(25-18)28-8-4-9-30(16-15-28)23(32)19-17-31-10-7-24-21(22(31)26-19)29-13-11-27(2)12-14-29/h3,5-7,10,17H,4,8-9,11-16H2,1-2H3
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| InChIKey |
HRFVPSLXDFKVGY-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