General Information of the Compound
| Compound ID |
CP0573906
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| Compound Name |
1-(2,2-dimethylpropyl)-3-[1-[[4-(methoxymethoxy)phenyl]methyl]-2,3-dihydroindol-5-yl]thiourea
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| Structure |
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| Formula |
C23H31N3O2S
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| Molecular Weight |
413.587
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| Canonical SMILES |
COCOc1ccc(CN2CCc3cc(NC(=S)NCC(C)(C)C)ccc23)cc1
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| InChI |
InChI=1S/C23H31N3O2S/c1-23(2,3)15-24-22(29)25-19-7-10-21-18(13-19)11-12-26(21)14-17-5-8-20(9-6-17)28-16-27-4/h5-10,13H,11-12,14-16H2,1-4H3,(H2,24,25,29)
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| InChIKey |
FSUNZGRBBQCVRF-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