COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL395411
Chemical Name: N-(1-benzyl-1H-pyrazol-3-yl)-5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Smiles: [O-][N+](=O)c1c(C)nn(c1C)CCc1nnc(s1)Nc1ccn(n1)Cc1ccccc1

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Molecular Weight: 424.49
Empirical Formula: C19H20N8O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.865
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 147
Number of rings: 4

     

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