COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898044
Chemical Name: methyl6-methyl-2-{[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(N/C=C/2\C(=NN(C2=O)c2ccccc2)C)sc2c1CCC(C2)C

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Molecular Weight: 409.51
Empirical Formula: C22H23N3O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.801
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 4

     

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