COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047690
Chemical Name: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){2-(3-fluorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Fc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

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Molecular Weight: 445.51
Empirical Formula: C22H24FN3O4S

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 2.305
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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