COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK578875
Chemical Name: 2'-hydroxy-3-nitro-1'-(prop-2-en-1-yl)-6a,7,8,9,10,11-hexahydro-4'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-4',6'(1'H)-dione
Smiles: C=CCN1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-])O

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Molecular Weight: 398.42
Empirical Formula: C20H22N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.203
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 4

     

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