COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443518
Chemical Name: 1-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-(2,3,4,5-tetrahydro-11H-[1,3]diazepino[1,2-a]benzimidazol-11-yl)ethanone
Smiles: O=C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)Cn1c2ccccc2n2c1=NCCCC2

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Saltdata: HBr
Molecular Weight: 433.59
Empirical Formula: C27H35N3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.598
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 4

     

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