COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK758170
Chemical Name: ethyl2-amino-1-(4-bromophenyl)-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(N)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1ccc(cc1)Br

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Molecular Weight: 501.44
Empirical Formula: C24H25BrN2O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.39
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 4

     

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