COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456139
Chemical Name: methyl2-({[1-(3,4-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]carbamothioyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1ncn(n1)Cc1ccc(c(c1)Cl)Cl)CC

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Molecular Weight: 555.51
Empirical Formula: C22H24Cl2N6O3S2

Physical State: Dry powder
Available Amount: 536 mg

Lipinsky:
logP: 6.259
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 161
Number of rings: 3

     

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