COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK047181
Chemical Name: (2E)-3-(3,5-di-tert-butyl-4-hydroxyphenyl)-2-(1-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)/c1nc2c(n1C)cccc2

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Molecular Weight: 387.52
Empirical Formula: C25H29N3O

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 6.92
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 61
Number of rings: 3

     

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