COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170978
Chemical Name: 4-({(Z)-[1-(3-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)phenylthiocyanate
Smiles: N#CSc1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

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Molecular Weight: 398.83
Empirical Formula: C18H11ClN4O3S

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 2.37
Rotatable bonds: 0
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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