COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK809626
Chemical Name: 4-{(Z)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl4-chlorobenzoate
Smiles: COCCCN1C(=S)S/C(=C\c2ccc(cc2)OC(=O)c2ccc(cc2)Cl)/C1=O

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Molecular Weight: 447.96
Empirical Formula: C21H18ClNO4S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 4.231
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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