COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK999780
Chemical Name: ethyl6-amino-2-({[6-tert-butyl-3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}methyl)-5-cyano-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc3CCC(Cc3c(c2C#N)c2ccc(cc2)OC)C(C)(C)C)OC(=C(C1c1cccs1)C#N)N

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Molecular Weight: 640.83
Empirical Formula: C35H36N4O4S2

Available Amount: 0 mg

Lipinsky:
logP: 7.908
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 184
Number of rings: 5

     

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