COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777349
Chemical Name: 7'-nitro-1-(prop-2-en-1-yl)-2-thioxo-1',2',3',3a'-tetrahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinoline]-4,6(1H,3H)-dione
Smiles: C=CCN1C(=S)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCC1)[N+](=O)[O-]

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Molecular Weight: 386.43
Empirical Formula: C18H18N4O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.667
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 130
Number of rings: 4

     

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