COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040400
Chemical Name: (E)-(7-methoxy-1-benzofuran-2-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 468.53
Empirical Formula: C24H24N2O6S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.855
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 124
Number of rings: 5

     

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