COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529597
Chemical Name: 2-{[4-(azepan-1-yl)-7-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethanol
Smiles: OCCNc1cc([N+](=O)[O-])c2c(c1N1CCCCCC1)non2

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Molecular Weight: 321.34
Empirical Formula: C14H19N5O4

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 2.632
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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