COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126203
Chemical Name: methyl4-({[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl}amino)-4-oxobutanoate
Smiles: COC(=O)CCC(=O)NC(=S)Nc1ccc(cc1)c1nc2c(s1)cc(cc2)C

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Molecular Weight: 413.52
Empirical Formula: C20H19N3O3S2

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 4.266
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 140
Number of rings: 3

     

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