COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427170
Chemical Name: (2E)-4-({5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}amino)-4-oxobut-2-enoicacid
Smiles: O=C(Nc1nnc(s1)COc1ccc(cc1)Cl)/C=C/C(=O)O

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Molecular Weight: 339.76
Empirical Formula: C13H10ClN3O4S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.406
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 2

     

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