COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560333
Chemical Name: 4-[6-bromo-3-(2-methoxy-2-oxoethyl)-4-phenyl-1,2,3,4-tetrahydroquinazolin-3-ium-2-yl]phenolate
Smiles: COC(=O)C[NH+]1C(Nc2c(C1c1ccccc1)cc(cc2)Br)c1ccc(cc1)[O-]

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Molecular Weight: 453.34
Empirical Formula: C23H21BrN2O3

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 4.322
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 65
Number of rings: 4

     

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