COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK309147
Chemical Name: 2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-9-(2-methylbutan-2-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCC(C1CCc2c(C1)sc1c2c2nc(nn2cn1)CCn1nc(c(c1C)[N+](=O)[O-])C)(C)C

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Molecular Weight: 467.6
Empirical Formula: C23H29N7O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.362
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 134
Number of rings: 5

     

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