COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL399401
Chemical Name: methyl2-{3-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Smiles: COC(=O)c1sc2c(c1C)c1nc(nn1cn2)c1cccc(c1)Cn1cc(c(n1)[N+](=O)[O-])Br

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Molecular Weight: 528.35
Empirical Formula: C20H14BrN7O4S

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 4.91
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 161
Number of rings: 5

     

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