COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050967
Chemical Name: (1'R,2'R)-7'-bromo-1'-(2,2-dimethylpropanoyl)-2'-(4-nitrophenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione
Smiles: Brc1ccc2c(c1)C=CC1N2[C@@H](C(=O)C(C)(C)C)[C@@H]([C@@]21C(=O)c1c(C2=O)cccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 585.45
Empirical Formula: C31H25BrN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.201
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 100
Number of rings: 6

     

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