COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599960
Chemical Name: 2-[(8-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline
Smiles: COc1cc2CCN(C(c2cc1OC)C)Cc1cc2OCCCOc2cc1Br

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Molecular Weight: 448.36
Empirical Formula: C22H26BrNO4

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 4.937
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 40
Number of rings: 4

     

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