COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957718
Chemical Name: 2-{[5-(3-nitrophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: C=CCn1c(SCC(=O)N/N=C/C=C/c2ccccc2)nnc1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 448.51
Empirical Formula: C22H20N6O3S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 5.867
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 143
Number of rings: 3

     

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