COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK026789
Chemical Name: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1Br)c(=O)oc(c2)C

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Molecular Weight: 403.19
Empirical Formula: C17H11BrN2O5

Physical State: Dry powder
Available Amount: 422 mg

Lipinsky:
logP: 2.05
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 103
Number of rings: 4

     

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