COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302438
Chemical Name: 5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cccc(c1)n1c(nnc1S)CCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 358.42
Empirical Formula: C16H18N6O2S

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 4.653
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 133
Number of rings: 3

     

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