COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL147909
Chemical Name: (E)-(2,4-dimethyl-1,3-thiazol-5-yl){1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: COc1ccc(cc1)C1N(CCCn2cc[nH+]c2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-]

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Molecular Weight: 452.53
Empirical Formula: C23H24N4O4S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.414
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 129
Number of rings: 4

     

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