COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL056800
Chemical Name: 2,4-dinitro-N-[(2E)-5-(pyridin-3-yl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: O=C(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/N=c/1\[nH]nc(s1)c1cccnc1

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Molecular Weight: 372.32
Empirical Formula: C14H8N6O5S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0.752
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 183
Number of rings: 3

     

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