COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK032776
Chemical Name: N-[5-(4-chlorobenzyl)-1,3,4-thiadiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide
Smiles: COc1cc(C(=O)Nc2nnc(s2)Cc2ccc(cc2)Cl)c(cc1OC)[N+](=O)[O-]

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Molecular Weight: 434.86
Empirical Formula: C18H15ClN4O5S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 4.12
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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