COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK205693
Chemical Name: methyl4-(4-benzylpiperazin-1-yl)-3-({[(2,5-dichlorophenyl)carbonyl]carbamothioyl}amino)benzoate
Smiles: COC(=O)c1ccc(c(c1)NC(=S)NC(=O)c1cc(Cl)ccc1Cl)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 557.5
Empirical Formula: C27H26Cl2N4O3S

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 5.122
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 106
Number of rings: 4

     

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