General Information of the Compound
| Compound ID |
CP0445398
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| Compound Name |
aminothiazole, 26
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| Structure |
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| Formula |
C34H26F3N3O4S
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| Molecular Weight |
629.66
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| Canonical SMILES |
OC(=O)CCNC(=O)c1ccc(cc1)N(Cc1ccc-2c(Cc3ccccc-23)c1)c1nc(cs1)-c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C34H26F3N3O4S/c35-34(36,37)44-27-12-8-22(9-13-27)30-20-45-33(39-30)40(26-10-6-23(7-11-26)32(43)38-16-15-31(41)42)19-21-5-14-29-25(17-21)18-24-3-1-2-4-28(24)29/h1-14,17,20H,15-16,18-19H2,(H,38,43)(H,41,42)
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| InChIKey |
CTOLIBJXQJXWDY-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