COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149378
Chemical Name: (E)-(4-bromophenyl){2-[4-(dimethylamino)phenyl]-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: Brc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)N(C)C)CCCn1cc[nH+]c1)/[O-]

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Molecular Weight: 509.4
Empirical Formula: C25H25BrN4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.156
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 4

     

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