COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK846562
Chemical Name: 1-[(2Z)-5-[(4-bromophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dimethylphenyl)urea
Smiles: Brc1ccc(cc1)OCc1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)C)C)/s1

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Molecular Weight: 433.33
Empirical Formula: C18H17BrN4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.485
Rotatable bonds: 2
H-donors: 2
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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