COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL031548
Chemical Name: {2-[(4-chlorophenyl)sulfonyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}aceticacid
Smiles: COc1cc2c(cc1OC)CCN(C2CC(=O)O)S(=O)(=O)c1ccc(cc1)Cl

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Molecular Weight: 425.89
Empirical Formula: C19H20ClNO6S

Physical State: Dry powder
Available Amount: 1009 mg

Lipinsky:
logP: 3.607
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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