COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307245
Chemical Name: 5-{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4-ethyl-4H-1,2,4-triazole-3-thiol
Smiles: CCn1c(S)nnc1c1ccc(cc1)Cn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 358.42
Empirical Formula: C16H18N6O2S

Physical State: Dry powder
Available Amount: 5056 mg

Lipinsky:
logP: 4.028
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 133
Number of rings: 3

     

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