COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL492810
Chemical Name: 1-(4-benzylpiperazin-1-yl)-4-(methylsulfanyl)-2-(1H-pyrrol-1-yl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)Cc1ccccc1)n1cccc1

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Molecular Weight: 357.52
Empirical Formula: C20H27N3OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.384
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 53
Number of rings: 3

     

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