General Information of the Compound
| Compound ID |
CP0465915
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| Compound Name |
N-[5-chloro-2-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-3-pyridin-2-ylsulfanylpropanamide
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| Structure |
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| Formula |
C17H16ClN3O2S
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| Molecular Weight |
361.854
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| Canonical SMILES |
Clc1ccc(C2=NCCO2)c(NC(=O)CCSc2ccccn2)c1
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| InChI |
InChI=1S/C17H16ClN3O2S/c18-12-4-5-13(17-20-8-9-23-17)14(11-12)21-15(22)6-10-24-16-3-1-2-7-19-16/h1-5,7,11H,6,8-10H2,(H,21,22)
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| InChIKey |
DMXYISUBAZCDOH-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