COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL437401
Chemical Name: 3-benzyl-2'-(4-chlorophenyl)-5'-methyl-8-(trifluoromethyl)-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Smiles: Clc1ccc(cc1)N1N=C(C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccccc1)C(F)(F)F)C

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Molecular Weight: 539
Empirical Formula: C29H26ClF3N4O

Physical State: Dry powder
Available Amount: 31 mg

Lipinsky:
logP: 6.488
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 39
Number of rings: 6

     

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