COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047001
Chemical Name: 2-(3,4-dimethoxyphenyl)-2-hydroxy-1-(4-methoxyphenyl)-1,2,3,5,6,7,8,9-octahydroimidazo[1,2-a]azepin-4-ium
Smiles: COc1ccc(cc1)N1C2=[N+](CC1(O)c1ccc(c(c1)OC)OC)CCCCC2

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Saltdata: Br-
Molecular Weight: 397.49
Empirical Formula: C23H29N2O4

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 54
Number of rings: 4

     

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