COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL145351
Chemical Name: methyl2-({[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonothioyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=S)N1CCN(CC1)c1cc(C)ccc1C

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Molecular Weight: 383.51
Empirical Formula: C21H25N3O2S

Physical State: Dry powder
Available Amount: 27 mg

Lipinsky:
logP: 4.259
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 76
Number of rings: 3

     

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