COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295777
Chemical Name: 4-[({(Z)-[1-(2-bromo-4,5-dimethylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}carbamoyl)amino]-3-methoxyphenylthiocyanate
Smiles: N#CSc1ccc(c(c1)OC)NC(=O)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cc(C)c(cc1Br)C

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Molecular Weight: 544.39
Empirical Formula: C22H18BrN5O5S

Physical State: Dry powder
Available Amount: 19 mg

Lipinsky:
logP: 3.307
Rotatable bonds: 2
H-donors: 3
H-acceptors: 5
PSA: 165
Number of rings: 3

     

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