COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK446348
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxyphenyl)piperazine-1-carbothioamide
Smiles: COc1cc(CCNC(=S)N2CCN(CC2)c2cccc(c2)O)ccc1OC

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Molecular Weight: 401.53
Empirical Formula: C21H27N3O3S

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 2.021
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 89
Number of rings: 3

     

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