COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560699
Chemical Name: (E)-[4,5-dioxo-2-(3-phenoxyphenyl)-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene][3-methyl-4-(2-methylpropoxy)phenyl]methanolate
Smiles: CC(COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)Oc1ccccc1)Cc1ccc[nH+]c1)/[O-])C

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Molecular Weight: 548.64
Empirical Formula: C34H32N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.204
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 5

     

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