COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL071407
Chemical Name: 2-{4-[(1E)-1,2-diphenylbut-1-en-1-yl]phenoxy}-N,N-dimethylethanamine2-hydroxypropane-1,2,3-tricarboxylate(salt)
Smiles: OC(=O)CC(C(=O)O)(CC(=O)O)O.CC/C(=C(/c1ccccc1)\c1ccc(cc1)OCCN(C)C)/c1ccccc1

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Molecular Weight: 563.65
Empirical Formula: C32H37NO8

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 0
Rotatable bonds: 12
H-donors: 4
H-acceptors: 8
PSA: 144
Number of rings: 3

     

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