COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454601
Chemical Name: N-(5-chloro-2-methoxyphenyl)-4-(2,3,4-trimethoxybenzyl)piperazine-1-carbothioamide
Smiles: COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=S)Nc1cc(Cl)ccc1OC

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Molecular Weight: 466
Empirical Formula: C22H28ClN3O4S

Physical State: Dry powder
Available Amount: 246 mg

Lipinsky:
logP: 2.927
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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