COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL402312
Chemical Name: 2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-N,N,9-trimethylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
Smiles: CN(C(=O)c1sc2c(c1C)c1nc(nn1cn2)CCn1nc(c(c1C)[N+](=O)[O-])C)C

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Molecular Weight: 428.47
Empirical Formula: C18H20N8O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.027
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 155
Number of rings: 4

     

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