COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151142
Chemical Name: 1-(3,4-dichlorophenyl)-3-[(2E)-5-[(4-nitrophenoxy)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(/N=c/1\[nH]nc(s1)COc1ccc(cc1)[N+](=O)[O-])Nc1ccc(c(c1)Cl)Cl

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Molecular Weight: 440.27
Empirical Formula: C16H11Cl2N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.325
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 146
Number of rings: 3

     

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