COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949543
Chemical Name: methyl2-({(2E)-2-cyano-3-[2-(propan-2-yloxy)phenyl]prop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: N#C/C(=C\c1ccccc1OC(C)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

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Molecular Weight: 398.48
Empirical Formula: C21H22N2O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.599
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 2

     

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