COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK492668
Chemical Name: methyl2-{[(2E)-2-cyano-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enoyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCOc1cc(ccc1O)/C=C(/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N(C)C)\C#N

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Molecular Weight: 457.51
Empirical Formula: C22H23N3O6S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.496
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 157
Number of rings: 2

     

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