COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050228
Chemical Name: 4-[4-(4-chlorobenzyl)piperazin-1-yl]-N-[(2Z)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: Clc1ccc(cc1)CN1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)C1CCCCC1

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Molecular Weight: 476.04
Empirical Formula: C23H30ClN5O2S

Physical State: Dry powder
Available Amount: 271 mg

Lipinsky:
logP: 3.246
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 4

     

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