COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL137704
Chemical Name: 1-(5-bromothiophen-2-yl)-2-{2-[(3-hydroxypropyl)amino]-5,6-dimethyl-1H-benzimidazol-1-yl}ethanone
Smiles: OCCCNc1nc2c(n1CC(=O)c1ccc(s1)Br)cc(c(c2)C)C

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Saltdata: HBr
Molecular Weight: 422.35
Empirical Formula: C18H20BrN3O2S

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 4.084
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 3

     

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