COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042380
Chemical Name: N-(2-chlorobenzyl)-2-[(10-hydroxy-4-oxo-6,7-dihydro-4H-pyrimido[6,1-a]isoquinolin-2-yl)amino]-N,N-dimethylethanaminium
Smiles: Oc1ccc2c(c1)c1cc(NCC[N+](Cc3ccccc3Cl)(C)C)nc(=O)n1CC2

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Saltdata: Cl-
Molecular Weight: 425.94
Empirical Formula: C23H26ClN4O2

Physical State: Dry powder
Available Amount: 167 mg

Lipinsky:
logP: -0.765
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 64
Number of rings: 4

     

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