COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL057801
Chemical Name: 4-[4-(2,4-dimethylbenzyl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: Cc1ccc(c(c1)C)CN1CCN(CC1)C(=O)CCC(=O)/N=c\1/[nH]nc(s1)C(C)C

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Molecular Weight: 429.59
Empirical Formula: C22H31N5O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.39
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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