COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK465875
Chemical Name: ({2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}sulfanyl)aceticacid
Smiles: O=C(NCc1ccc2c(c1)OCO2)CSCC(=O)O

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Molecular Weight: 283.3
Empirical Formula: C12H13NO5S

Physical State: Dry powder
Available Amount: 801 mg

Lipinsky:
logP: 1.017
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 110
Number of rings: 2

     

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