COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL329752
Chemical Name: methyl6-methyl-2-{[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)Cn2cnc(n2)[N+](=O)[O-])sc2c1CCC(C2)C

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Molecular Weight: 379.4
Empirical Formula: C15H17N5O5S

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 3.012
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 160
Number of rings: 3

     

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