COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567932
Chemical Name: 4-{4-[(4-chlorophenoxy)methyl]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)COc2ccc(cc2)Cl)/s1

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Molecular Weight: 451.98
Empirical Formula: C20H26ClN5O3S

Physical State: Dry powder
Available Amount: 298 mg

Lipinsky:
logP: 2.634
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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