COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL436389
Chemical Name: [4-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-2,2-dimethylquinolin-1(2H)-yl](phenyl)methanone
Smiles: OCCN1CCN(CC1)CC1=CC(C)(C)N(c2c1cccc2)C(=O)c1ccccc1

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Saltdata: HCI
Molecular Weight: 405.54
Empirical Formula: C25H31N3O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.913
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 47
Number of rings: 4

     

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