COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053401
Chemical Name: 1-(3,4-dimethylphenyl)-1',6'-dimethyl-2,6-dioxo-1,1',4',6-tetrahydro-2H,2'H-spiro[pyrimidine-5,3'-quinolinium]-4-olate
Smiles: Cc1ccc2c(c1)CC1(C[NH+]2C)C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)[O-]

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Molecular Weight: 377.44
Empirical Formula: C22H23N3O3

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 3.462
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 77
Number of rings: 4

     

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