COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK598826
Chemical Name: (1Z)-1-{[(4-ethoxyphenyl)sulfonyl]methylidene}-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: CCOc1ccc(cc1)S(=O)(=O)/C=C/1\NCCc2c1cc(OC)c(c2)OC

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Molecular Weight: 389.47
Empirical Formula: C20H23NO5S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.745
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 82
Number of rings: 3

     

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