COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565232
Chemical Name: (E)-(2-methyl-2,3-dihydro-1-benzofuran-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}methanolate
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)C)CC[NH+]1CCOCC1)/[O-]

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Molecular Weight: 490.6
Empirical Formula: C29H34N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.692
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 83
Number of rings: 5

     

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