COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL490823
Chemical Name: 2-(1,4-diazepan-1-ylmethyl)-5-hydroxy-4H-pyran-4-one
Smiles: Oc1coc(cc1=O)CN1CCNCCC1

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Saltdata: 2 HCl
Molecular Weight: 224.26
Empirical Formula: C11H16N2O3

Physical State: Dry powder
Available Amount: 1005 mg

Lipinsky:
logP: 0.509
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 61
Number of rings: 2

     

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