COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041329
Chemical Name: 4-[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]-4-oxo-N-[(2Z)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)c2nc(C)cc(n2)C)/s1

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Molecular Weight: 417.54
Empirical Formula: C19H27N7O2S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 1.785
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 128
Number of rings: 3

     

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