COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302597
Chemical Name: 5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(3-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cccc(c1)n1c(nnc1S)CCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 374.42
Empirical Formula: C16H18N6O3S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 4.109
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 142
Number of rings: 3

     

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