COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323163
Chemical Name: ethyl(5E)-4-(4-bromophenyl)-5-(hydroxyimino)-2,7,7-trimethyl-5,6,7,8-tetrahydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Br)/C(=N/O)/CC(C2)(C)C

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Molecular Weight: 431.33
Empirical Formula: C21H23BrN2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.439
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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