COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383132
Chemical Name: 4-[({(Z)-[1-(4-bromo-2-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}carbamoyl)amino]phenylthiocyanate
Smiles: N#CSc1ccc(cc1)NC(=O)N/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1C)Br

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Molecular Weight: 500.33
Empirical Formula: C20H14BrN5O4S

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 2.849
Rotatable bonds: 0
H-donors: 3
H-acceptors: 4
PSA: 156
Number of rings: 3

     

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