COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544946
Chemical Name: (1'R,2'S,3R)-2'-[(4-fluorophenyl)carbonyl]-1'-[(3-nitrophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)c2cccc(c2)[N+](=O)[O-])N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

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Molecular Weight: 559.55
Empirical Formula: C33H22FN3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.253
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 7

     

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