COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL228313
Chemical Name: ethyl4-(3,4-dimethylphenyl)-2-({[(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(c(c1)C)C)NC(=O)CSc1nnc2n1c1ccccc1c(c2)C

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Molecular Weight: 530.67
Empirical Formula: C28H26N4O3S2

Available Amount: 0 mg

Lipinsky:
logP: 8.334
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 139
Number of rings: 5

     

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