General Information of the Compound
| Compound ID |
CP0386983
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| Compound Name |
N-[(5-acetyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]-2-chloro-4-ethoxy-5-morpholin-4-ylbenzamide
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| Structure |
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| Formula |
C22H26ClN5O5S
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| Molecular Weight |
508
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| Canonical SMILES |
CCOc1cc(Cl)c(cc1N1CCOCC1)C(=O)NC(=O)Nc1nc2CCN(Cc2s1)C(C)=O
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| InChI |
InChI=1S/C22H26ClN5O5S/c1-3-33-18-11-15(23)14(10-17(18)27-6-8-32-9-7-27)20(30)25-21(31)26-22-24-16-4-5-28(13(2)29)12-19(16)34-22/h10-11H,3-9,12H2,1-2H3,(H2,24,25,26,30,31)
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| InChIKey |
SUPPGYHTAHGWHH-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