COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580388
Chemical Name: (2Z)-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-1-{1-[(2-fluorophenyl)sulfonyl]piperidin-4-yl}ethanone
Smiles: COc1cc2/C(=C/C(=O)C3CCN(CC3)S(=O)(=O)c3ccccc3F)/NCCc2cc1OC

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Molecular Weight: 474.55
Empirical Formula: C24H27FN2O5S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.131
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 4

     

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