COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949535
Chemical Name: ethyl2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(cc2)N(CC)CC)/C#N)sc(c1C)C

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Molecular Weight: 425.55
Empirical Formula: C23H27N3O3S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.815
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 110
Number of rings: 2

     

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