COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040341
Chemical Name: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}methanolate
Smiles: Cc1nc(c(s1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)CC[NH+]1CCOCC1)/[O-])C

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Molecular Weight: 427.52
Empirical Formula: C22H25N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.253
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 115
Number of rings: 4

     

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