COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573402
Chemical Name: 12-methyl-7-[(4-nitrobenzyl)sulfanyl]-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidine
Smiles: CC1CCc2c(C1)c1c(s2)n2c(SCc3ccc(cc3)[N+](=O)[O-])nnc2n2c1ncn2

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Molecular Weight: 451.53
Empirical Formula: C20H17N7O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.698
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 159
Number of rings: 6

     

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