COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043163
Chemical Name: 2-{[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl]oxy}-N,N,N-trimethylethanaminium
Smiles: O=C(CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)OCC[N+](C)(C)C

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Saltdata: I-
Molecular Weight: 364.55
Empirical Formula: C22H38NO3

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.818
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 46
Number of rings: 1

     

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