COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456412
Chemical Name: ethyl4-({[4-(3,4-dichlorobenzyl)piperazin-1-yl]carbonothioyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)N1CCN(CC1)Cc1ccc(c(c1)Cl)Cl

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Molecular Weight: 452.4
Empirical Formula: C21H23Cl2N3O2S

Physical State: Dry powder
Available Amount: 500 mg

Lipinsky:
logP: 4.476
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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