COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754727
Chemical Name: ethyl(5Z)-5-(naphthalen-1-ylimino)-4-(4-nitrophenyl)-4,5-dihydro-1,3,4-thiadiazole-2-carboxylate
Smiles: CCOC(=O)c1nn(/c(=N/c2cccc3c2cccc3)/s1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 420.45
Empirical Formula: C21H16N4O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.554
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 125
Number of rings: 4

     

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