COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL437423
Chemical Name: ethyl4-[8-bromo-3-(3-chlorophenyl)-3'-methyl-5'-oxo-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-1'(5'H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1N=C(C2(C1=O)Cc1cc(Br)ccc1N1C2CN(CC1)c1cccc(c1)Cl)C

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Molecular Weight: 607.93
Empirical Formula: C30H28BrClN4O3

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 6.976
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 65
Number of rings: 6

     

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