COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611936
Chemical Name: 3-nitro-1'-(propan-2-yl)-2'-sulfanyl-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: CC(N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-])S)C

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Molecular Weight: 416.5
Empirical Formula: C20H24N4O4S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 4.253
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 137
Number of rings: 4

     

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