COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK200284
Chemical Name: methyl2-{[(E)-(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(/N=C/c2cc(cc(c2O)Br)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 439.29
Empirical Formula: C17H15BrN2O5S

Physical State: Dry powder
Available Amount: 153 mg

Lipinsky:
logP: 6.465
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 132
Number of rings: 3

     

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