COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK580964
Chemical Name: 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-2-{4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}ethanone
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C

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Molecular Weight: 487.62
Empirical Formula: C25H33N3O5S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 4.18
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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