COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852096
Chemical Name: 4-{[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: S=c1[nH]nc(n1/N=C/C=C/c1ccccc1[N+](=O)[O-])c1ccncc1

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Molecular Weight: 352.38
Empirical Formula: C16H12N6O2S

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 1.704
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 130
Number of rings: 3

     

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