COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149211
Chemical Name: 1-[4-(4-chlorophenyl)-4-oxo-3-phenylbutyl]azepanium
Smiles: Clc1ccc(cc1)C(=O)C(c1ccccc1)CC[NH+]1CCCCCC1

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Saltdata: Cl-
Molecular Weight: 356.92
Empirical Formula: C22H27ClNO

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.515
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 21
Number of rings: 3

     

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