COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK480506
Chemical Name: ({2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)aceticacid
Smiles: O=C(N1CCN(CC1)c1cccc(c1C)C)CSCC(=O)O

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Molecular Weight: 322.43
Empirical Formula: C16H22N2O3S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.315
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 2

     

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