COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK423561
Chemical Name: diethyl3-methyl-5-[({2-[4-(propan-2-yl)phenyl]quinolin-4-yl}carbonyl)amino]thiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2ccc(cc2)C(C)C)sc(c1C)C(=O)OCC

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Molecular Weight: 530.64
Empirical Formula: C30H30N2O5S

Physical State: Dry powder
Available Amount: 3234 mg

Lipinsky:
logP: 9.332
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 122
Number of rings: 4

     

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