COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367623
Chemical Name: 2-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-N-(3,4-dimethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: O=C(c1c(/N=C/c2ccc3c(c2)OCO3)sc2c1CCCC2)Nc1ccc(c(c1)C)C

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Molecular Weight: 432.54
Empirical Formula: C25H24N2O3S

Physical State: Dry powder
Available Amount: 556 mg

Lipinsky:
logP: 5.8
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 88
Number of rings: 5

     

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