COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612548
Chemical Name: 6-hydroxy-7'-nitro-3-(3-sulfanylpropyl)-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-2,4(3H)-dione
Smiles: SCCCN1C(=O)N=C(C2(C1=O)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-])O

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Molecular Weight: 404.45
Empirical Formula: C18H20N4O5S

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 2.16
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 157
Number of rings: 4

     

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