COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206897
Chemical Name: methyl2-{[(4-benzylpiperazin-1-yl)carbonothioyl]amino}-4,5-dimethoxybenzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=S)N1CCN(CC1)Cc1ccccc1)OC

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Molecular Weight: 429.54
Empirical Formula: C22H27N3O4S

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 3.812
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 3

     

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