COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383419
Chemical Name: 5',6'-dimethoxy-1'-[(4-methylphenyl)sulfonyl]-2',3',8',8a'-tetrahydro-1'H,4H-spiro[cyclohexa-2,5-diene-1,7'-cyclopenta[ij]isoquinolin]-4-one
Smiles: COc1c(OC)cc2c3c1C1(C=CC(=O)C=C1)CC3N(CC2)S(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 451.54
Empirical Formula: C25H25NO5S

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 3.665
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 81
Number of rings: 5

     

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