COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK472796
Chemical Name: N-[4-(butan-2-yl)phenyl]-4-[(3,4-dimethylphenyl)sulfonyl]piperazine-1-carbothioamide
Smiles: CCC(c1ccc(cc1)NC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C)C

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Molecular Weight: 445.65
Empirical Formula: C23H31N3O2S2

Physical State: Dry powder
Available Amount: 361 mg

Lipinsky:
logP: 5.008
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 93
Number of rings: 3

     

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