COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL399360
Chemical Name: methyl2-{1-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Smiles: COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1ccn(n1)Cn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 467.47
Empirical Formula: C19H17N9O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.558
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 179
Number of rings: 5

     

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