COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670495
Chemical Name: ethyl5-({(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)N/C=C/1\C(=NN(C1=O)c1cccc(c1)Cl)C

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Molecular Weight: 428.9
Empirical Formula: C20H17ClN4O3S

Physical State: Dry powder
Available Amount: 790 mg

Lipinsky:
logP: 4.159
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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