COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK398879
Chemical Name: N-{[4-(4-chloro-2,3,5,6-tetrafluorophenyl)piperazin-1-yl]carbonothioyl}-1,3-benzodioxole-5-carboxamide
Smiles: S=C(N1CCN(CC1)c1c(F)c(F)c(c(c1F)F)Cl)NC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 475.85
Empirical Formula: C19H14ClF4N3O3S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 2.928
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 4

     

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