COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898034
Chemical Name: 2-tert-butyl4-methyl3-methyl-5-{[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}thiophene-2,4-dicarboxylate
Smiles: COC(=O)c1c(N/C=C/2\C(=NN(C2=O)c2ccccc2)C)sc(c1C)C(=O)OC(C)(C)C

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Molecular Weight: 455.53
Empirical Formula: C23H25N3O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.839
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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