COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007215
Chemical Name: 1'-(2-chlorophenyl)-3-nitro-2'-thioxo-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-4',6'(1'H,3'H)-dione
Smiles: S=C1NC(=O)C2(C(=O)N1c1ccccc1Cl)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

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Molecular Weight: 484.96
Empirical Formula: C23H21ClN4O4S

Available Amount: 0 mg

Lipinsky:
logP: 5.276
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 130
Number of rings: 5

     

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