General Information of the Compound
| Compound ID |
CP0443413
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| Compound Name |
aminothiazole, 20
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| Structure |
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| Formula |
C28H24F3N3O4S2
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| Molecular Weight |
587.645
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| Canonical SMILES |
COc1ccccc1-c1csc(n1)N(Cc1ccc(cc1)C(=O)NCCC(O)=O)c1ccc(SC(F)(F)F)cc1
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| InChI |
InChI=1S/C28H24F3N3O4S2/c1-38-24-5-3-2-4-22(24)23-17-39-27(33-23)34(20-10-12-21(13-11-20)40-28(29,30)31)16-18-6-8-19(9-7-18)26(37)32-15-14-25(35)36/h2-13,17H,14-16H2,1H3,(H,32,37)(H,35,36)
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| InChIKey |
SWIHUIGRFYPTCP-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
Protein ID: PT02242, Gastric inhibitory polypeptide receptor
Protein ID: PT01473, Glucagon receptor