COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK334799
Chemical Name: (4S,7S)-2-phenyl-7-(thiophen-2-yl)-4-(2,4,5-trimethoxyphenyl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Smiles: COc1cc(OC)c(cc1[C@H]1C2=C(C[C@@H](CC2=O)c2cccs2)Nc2c1c(=O)n([nH]2)c1ccccc1)OC

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Molecular Weight: 529.62
Empirical Formula: C29H27N3O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.197
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 117
Number of rings: 6

     

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