COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617895
Chemical Name: (1'S,3S,3'S)-3'-[(4-bromophenyl)carbonyl]-1'-[(3,4,5-trimethoxyphenyl)carbonyl]-1',10b'-dihydrospiro[indole-3,2'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Smiles: COc1cc(cc(c1OC)OC)C(=O)[C@@H]1C2c3ccccc3C=CN2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br

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Molecular Weight: 665.54
Empirical Formula: C36H29BrN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.676
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 94
Number of rings: 7

     

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