COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330912
Chemical Name: (4Z)-1-(3-chlorophenyl)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]pyrazolidine-3,5-dione
Smiles: COc1cc(/C=C\2/C(=O)NN(C2=O)c2cccc(c2)Cl)cc2c1oc(=O)s2

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Molecular Weight: 402.81
Empirical Formula: C18H11ClN2O5S

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 3.504
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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