COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832903
Chemical Name: (1Z)-4,4-dimethyl-1-(3-nitrophenyl)-2-(1H-1,2,4-triazol-1-yl)pent-1-en-3-one
Smiles: O=C(C(C)(C)C)/C(=C/c1cccc(c1)[N+](=O)[O-])/n1cncn1

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Molecular Weight: 300.32
Empirical Formula: C15H16N4O3

Physical State: Dry powder
Available Amount: 133 mg

Lipinsky:
logP: 2.5
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 2

     

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