COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380970
Chemical Name: 2,5-dimethyl-4-({(Z)-[2,4,6-trioxo-1-(2-phenylethyl)tetrahydropyrimidin-5(2H)-ylidene]methyl}amino)phenylthiocyanate
Smiles: N#CSc1cc(C)c(cc1C)N/C=C\1/C(=O)NC(=O)N(C1=O)CCc1ccccc1

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Molecular Weight: 420.49
Empirical Formula: C22H20N4O3S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 3.135
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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