COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472821
Chemical Name: methyl2-({(2E)-2-cyano-3-[4-(pentyloxy)phenyl]prop-2-enoyl}amino)-5-propylthiophene-3-carboxylate
Smiles: CCCCCOc1ccc(cc1)/C=C(/C(=O)Nc1sc(cc1C(=O)OC)CCC)\C#N

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Molecular Weight: 440.56
Empirical Formula: C24H28N2O4S

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 8.388
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 2

     

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