COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL050913
Chemical Name: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-methyl-1'-[2-(morpholin-4-ium-4-yl)ethyl]-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: [O-]/C(=C\1/C(=O)C(=O)N(C21C(=O)N(c1c2cccc1)C)CC[NH+]1CCOCC1)/c1ccc2c(c1)OCCO2

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Molecular Weight: 505.53
Empirical Formula: C27H27N3O7

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 3.138
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 112
Number of rings: 6

     

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