COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455778
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-ethoxyphenyl)piperazine-1-carbothioamide
Smiles: CCOc1ccccc1N1CCN(CC1)C(=S)NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 429.58
Empirical Formula: C23H31N3O3S

Physical State: Dry powder
Available Amount: 251 mg

Lipinsky:
logP: 3.335
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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