COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600200
Chemical Name: N'-[3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-phenylbutyl]-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNCCC(C1CCOC(C1)(C)C)Cc1ccccc1)C

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Saltdata: (COOH)2
Molecular Weight: 332.53
Empirical Formula: C21H36N2O

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.578
Rotatable bonds: 7
H-donors: 1
H-acceptors: 1
PSA: 24
Number of rings: 2

     

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