COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064995
Chemical Name: 2-phenylethyl4-[({2-[(3,5-dimethylphenoxy)acetyl]hydrazinyl}carbonothioyl)amino]-4-oxobutanoate
Smiles: O=C(NC(=S)NNC(=O)COc1cc(C)cc(c1)C)CCC(=O)OCCc1ccccc1

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Molecular Weight: 457.55
Empirical Formula: C23H27N3O5S

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 3.675
Rotatable bonds: 9
H-donors: 3
H-acceptors: 5
PSA: 137
Number of rings: 2

     

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