COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053021
Chemical Name: 4-(azepan-1-yl)-N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C1CCCCC1)CCC(=O)N1CCCCCC1

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Molecular Weight: 364.51
Empirical Formula: C18H28N4O2S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 2.789
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 99
Number of rings: 3

     

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