COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL505057
Chemical Name: ethyl2-[({[5-(2,4-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc([nH]2)c2ccc(cc2Cl)Cl)sc2c1CCCC2

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Molecular Weight: 511.45
Empirical Formula: C21H20Cl2N4O3S2

Physical State: Dry powder
Available Amount: 501 mg

Lipinsky:
logP: 7.466
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 150
Number of rings: 4

     

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