COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491078
Chemical Name: 4-(methylsulfanyl)-1-[4-(2-phenoxyethyl)piperazin-1-yl]-2-(1H-pyrrol-1-yl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)CCOc1ccccc1)n1cccc1

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Molecular Weight: 387.55
Empirical Formula: C21H29N3O2S

Physical State: Liquid
Available Amount: 5 mg

Lipinsky:
logP: 3.663
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 63
Number of rings: 3

     

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