COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055920
Chemical Name: 3-(3,4-dichlorophenyl)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Smiles: O=C(Cn1cc([n+]2c1CCC2)c1ccc(c(c1)Cl)Cl)Nc1ccc2c(c1)OCCO2

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Saltdata: Cl-
Molecular Weight: 445.32
Empirical Formula: C22H20Cl2N3O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 56
Number of rings: 5

     

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