COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL013041
Chemical Name: (1Z)-1-(3,4-diethoxybenzylidene)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline
Smiles: CCOc1cc(ccc1OCC)/C=C\1/NCCc2c1cc(OCC)c(c2)OCC

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Saltdata: HCl
Molecular Weight: 397.51
Empirical Formula: C24H31NO4

Physical State: Dry powder
Available Amount: 2308 mg

Lipinsky:
logP: 6.147
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 48
Number of rings: 3

     

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