COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK965745
Chemical Name: methyl6-tert-butyl-2-{[(1-methyl-4-nitro-1H-pyrazol-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1nn(cc1[N+](=O)[O-])C

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Molecular Weight: 420.49
Empirical Formula: C19H24N4O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.325
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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