COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK803670
Chemical Name: (2Z)-3-{4-[2-(4-chlorophenyl)-2-oxoethoxy]-3-methoxyphenyl}-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1cc(ccc1OCC(=O)c1ccc(cc1)Cl)/C=C(\c1scc(n1)c1cccc(c1)[N+](=O)[O-])/C#N

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Molecular Weight: 531.98
Empirical Formula: C27H18ClN3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.572
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 146
Number of rings: 4

     

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