COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096511
Chemical Name: methyl({2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}sulfanyl)acetate
Smiles: COC(=O)CSCC(=O)Nc1cc2OCOc2cc1C(=O)C

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Molecular Weight: 325.34
Empirical Formula: C14H15NO6S

Physical State: Dry powder
Available Amount: 389 mg

Lipinsky:
logP: 2.368
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 116
Number of rings: 2

     

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