General Information of the Compound
| Compound ID |
CP0579314
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| Compound Name |
2-[3-[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]-1,4-dioxa-8-azaspiro[4.5]decan-8-yl]-4-fluoro-1,3-benzothiazole-6-carboxylic acid
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| Structure |
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| Formula |
C27H22Cl2FN3O5S
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| Molecular Weight |
590.46
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| Canonical SMILES |
OC(=O)c1cc(F)c2nc(sc2c1)N1CCC2(CC1)OCC(O2)c1c(onc1-c1c(Cl)cccc1Cl)C1CC1
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| InChI |
InChI=1S/C27H22Cl2FN3O5S/c28-15-2-1-3-16(29)20(15)23-21(24(38-32-23)13-4-5-13)18-12-36-27(37-18)6-8-33(9-7-27)26-31-22-17(30)10-14(25(34)35)11-19(22)39-26/h1-3,10-11,13,18H,4-9,12H2,(H,34,35)
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| InChIKey |
YAQKEYXGXVYKFQ-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