COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL054617
Chemical Name: (1'R,2'R)-1'-[(3-nitrophenyl)carbonyl]-2'-[4-(trifluoromethyl)phenyl]-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: O=C([C@@H]1N2c3ccccc3C=CC2[C@@]2([C@H]1c1ccc(cc1)C(F)(F)F)C(=O)c1c(C2=O)cccc1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 594.55
Empirical Formula: C34H21F3N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.268
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 7

     

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