COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491158
Chemical Name: 1-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-4-(methylsulfanyl)-2-(1H-pyrrol-1-yl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)C(c1ccc(cc1)Cl)c1ccccc1)n1cccc1

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Molecular Weight: 468.06
Empirical Formula: C26H30ClN3OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.471
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 53
Number of rings: 4

     

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