COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054098
Chemical Name: 4-{4-[(5-bromothiophen-2-yl)sulfonyl]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)S(=O)(=O)c2ccc(s2)Br)/s1

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Molecular Weight: 536.49
Empirical Formula: C17H22BrN5O4S3

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 2.222
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 173
Number of rings: 3

     

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