COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK441533
Chemical Name: ethyl2-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc2c1cccc2

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Molecular Weight: 396.42
Empirical Formula: C20H16N2O5S

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 7.972
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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