COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265808
Chemical Name: 1-(2,5-dimethylphenyl)-3-hydroxy-3-(thiophen-2-yl)-2,5,6,7,8,9-hexahydro-3H-imidazo[1,2-a]azepin-1-ium
Smiles: Cc1ccc(c(c1)[N+]1=C2CCCCCN2C(C1)(O)c1cccs1)C

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Saltdata: Br-
Molecular Weight: 341.5
Empirical Formula: C20H25N2OS

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 54
Number of rings: 4

     

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