COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK940444
Chemical Name: [5-(cyanomethoxy)-1H-indol-3-yl][4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]aceticacid
Smiles: N#CCOc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)C1CCS(=O)(=O)C1)C(=O)O

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Molecular Weight: 432.5
Empirical Formula: C20H24N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.471
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 135
Number of rings: 4

     

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