COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566310
Chemical Name: 4-butoxy-N-[(2E)-5-(3-nitrophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: CCCCOc1ccc(cc1)C(=O)/N=c/1\[nH]nc(s1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 398.44
Empirical Formula: C19H18N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.338
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 134
Number of rings: 3

     

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