COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK099550
Chemical Name: 1-(3-methoxyphenyl)-3-{5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2-yl}urea
Smiles: COc1cccc(c1)NC(=O)Nc1nnc(s1)COc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 401.4
Empirical Formula: C17H15N5O5S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 3.137
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 159
Number of rings: 3

     

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