COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL124795
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]{6-[(3,4-dimethylphenyl)sulfonyl]pyridin-3-yl}methanone
Smiles: O=C(c1ccc(nc1)S(=O)(=O)c1ccc(c(c1)C)C)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 493.58
Empirical Formula: C26H27N3O5S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 2.587
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 5

     

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