COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK883405
Chemical Name: 2-oxo-7-phenyl-1,3-benzoxathiol-5-yl4-chloro-3-nitrobenzoate
Smiles: O=c1oc2c(s1)cc(cc2c1ccccc1)OC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 427.82
Empirical Formula: C20H10ClNO6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.926
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 123
Number of rings: 4

     

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