COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305598
Chemical Name: 9-tert-butyl-2-[(3-methoxy-4-nitro-1H-pyrazol-1-yl)methyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: COc1nn(cc1[N+](=O)[O-])Cc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(C)C

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Molecular Weight: 441.51
Empirical Formula: C20H23N7O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.824
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 144
Number of rings: 5

     

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