COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK281737
Chemical Name: ethyl2-{[(E)-(4-nitrophenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2ccc(cc2)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 358.42
Empirical Formula: C18H18N2O4S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 5.462
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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