COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059134
Chemical Name: {3,3',3'',3'''-(porphyrin-5,10,15,20-tetrayl-kappa~2~N~21~,N~23~)tetrakis[1-butylpyridiniumato(2-)]}zinc(4+)
Smiles: CCCC[n+]1cccc(c1)C1=C2C=CC(=N2)C(=c2n3[Zn]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1ccc[n+](c1)CCCC)c1ccc[n+](c1)CCCC)c1ccc[n+](c1)CCCC

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Saltdata: 4 Br-
Molecular Weight: 910.54
Empirical Formula: C56H60N8Zn

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 16
H-donors: 0
H-acceptors: 0
PSA: 48
Number of rings: 10

     

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