COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL043282
Chemical Name: {(2E)-2-benzylidene-4-oxo-7-phenyl-6-[(triphenylphosphonio)methyl]hept-6-en-1-yl}(triphenyl)phosphonium
Smiles: O=C(C/C(=C\c1ccccc1)/C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C/C(=C\c1ccccc1)/C[P+](c1ccccc1)(c1ccccc1)c1ccccc1

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Saltdata: 2 Br-
Molecular Weight: 812.97
Empirical Formula: C57H50OP2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 17
Number of rings: 8

     

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