COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334083
Chemical Name: (4S,7S)-4-(5-bromothiophen-2-yl)-2-phenyl-7-(thiophen-2-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Smiles: Brc1ccc(s1)C1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(=O)n([nH]2)c1ccccc1

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Molecular Weight: 524.46
Empirical Formula: C24H18BrN3O2S2

Physical State: Dry powder
Available Amount: 587 mg

Lipinsky:
logP: 4.144
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 117
Number of rings: 6

     

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