COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046646
Chemical Name: 1-(4-fluorophenyl)-3-[(2E)-5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: Fc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)COc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 389.37
Empirical Formula: C16H12FN5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.877
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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