COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL051845
Chemical Name: N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-nitrobenzamide
Smiles: COc1cc(ccc1OC)c1n[nH]/c(=N\C(=O)c2cccc(c2)[N+](=O)[O-])/s1

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Molecular Weight: 386.39
Empirical Formula: C17H14N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.496
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 143
Number of rings: 3

     

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