COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL101631
Chemical Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-iodo-4-methoxyphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1I)S(=O)(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 516.36
Empirical Formula: C19H21IN2O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.96
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 4

     

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