COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552980
Chemical Name: 2,3,10,11-tetramethoxy-8-(4-methylphenyl)-8,13-dihydroisoquino[3,2-a]isoquinolinium
Smiles: COc1cc2c(cc1OC)Cc1[n+](C2c2ccc(cc2)C)ccc2c1cc(OC)c(c2)OC

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Saltdata: Cl-
Molecular Weight: 442.53
Empirical Formula: C28H28NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.13
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 40
Number of rings: 5

     

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