COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK585151
Chemical Name: 3'-[2-(3,4-dimethoxyphenyl)ethyl]-6'-hydroxy-3-methyl-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2CN(C)CC1)[N+](=O)[O-])O

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Molecular Weight: 523.55
Empirical Formula: C26H29N5O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.12
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 140
Number of rings: 5

     

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