COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK038319
Chemical Name: 2-amino-4-(4-hydroxy-3,5-dinitrophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])O)c(=O)oc(c2)C

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Molecular Weight: 386.28
Empirical Formula: C16H10N4O8

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 0.94
Rotatable bonds: 1
H-donors: 3
H-acceptors: 8
PSA: 197
Number of rings: 3

     

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