COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535208
Chemical Name: 2,2'-(6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine-2,14-diyldisulfonyl)bis(6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline)
Smiles: COc1cc2c(cc1OC)CCN(C2C)S(=O)(=O)c1ccc2c(c1)OCCOCCOc1c(OCCOCCO2)ccc(c1)S(=O)(=O)N1CCc2c(C1C)cc(c(c2)OC)OC

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Molecular Weight: 899.05
Empirical Formula: C44H54N2O14S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.619
Rotatable bonds: 6
H-donors: 0
H-acceptors: 14
PSA: 183
Number of rings: 7

     

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