COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK412832
Chemical Name: methyl4-cyano-5-{[(2E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino}-3-methylthiophene-2-carboxylate
Smiles: COC(=O)c1sc(c(c1C)C#N)NC(=O)/C=C/c1ccc(cc1Cl)Cl

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Molecular Weight: 395.27
Empirical Formula: C17H12Cl2N2O3S

Physical State: Dry powder
Available Amount: 953 mg

Lipinsky:
logP: 5.468
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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