COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL241373
Chemical Name: methyl1-[(4-chlorophenyl)carbonyl]-3-cyano-2-(4-nitrophenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Smiles: COC(=O)C1(C#N)C(c2ccc(cc2)[N+](=O)[O-])C(N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl

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Molecular Weight: 513.94
Empirical Formula: C28H20ClN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.45
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 116
Number of rings: 5

     

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