COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446779
Chemical Name: N-(1,3-benzodioxol-5-yl)-1-[{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}(4-fluorobenzyl)amino]cyclohexanecarboxamide
Smiles: Fc1ccc(cc1)CN(C1(CCCCC1)C(=O)Nc1ccc2c(c1)OCO2)C(=O)CSc1nc(C)cc(n1)C

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Molecular Weight: 550.65
Empirical Formula: C29H31FN4O4S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 6.044
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 5

     

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