COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL174431
Chemical Name: 2-amino-4-(5-tert-butylthiophen-2-yl)-1-(3,4-dichlorophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(c(c2)Cl)Cl)C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CC(C2)c1ccccc1

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Molecular Weight: 548.54
Empirical Formula: C30H27Cl2N3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.617
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 98
Number of rings: 5

     

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