COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374325
Chemical Name: (5E)-1-(2,3-dichlorophenyl)-5-[3-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: C#CCOc1ccc(cc1OC)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1Cl)Cl

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Molecular Weight: 461.32
Empirical Formula: C21H14Cl2N2O4S

Physical State: Dry powder
Available Amount: 1010 mg

Lipinsky:
logP: 4.185
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 3

     

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