General Information of the Compound
| Compound ID |
CP0853936
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| Compound Name |
cyclobutyl(4-((6-(2-fluorophenyl)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl)methyl)piperazin-1-yl)methanone
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| Structure |
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| Formula |
C30H31FN4O2
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| Molecular Weight |
498.602
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| Canonical SMILES |
COc1cccc(-c2nc3ccc(-c4ccccc4F)cn3c2CN2CCN(C(=O)C3CCC3)CC2)c1
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| InChI |
InChI=1S/C30H31FN4O2/c1-37-24-9-5-8-22(18-24)29-27(20-33-14-16-34(17-15-33)30(36)21-6-4-7-21)35-19-23(12-13-28(35)32-29)25-10-2-3-11-26(25)31/h2-3,5,8-13,18-19,21H,4,6-7,14-17,20H2,1H3
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| InChIKey |
GCTATEMCMZSCCR-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