COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576183
Chemical Name: (E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-methyl-1'-[3-(morpholin-4-ium-4-yl)propyl]-2,4',5'-trioxo-1,2-dihydro-3'H-spiro[indole-3,2'-pyrrolidin]-3'-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C2(N1CCC[NH+]1CCOCC1)C(=O)N(c1c2cccc1)C

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Molecular Weight: 519.55
Empirical Formula: C28H29N3O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.093
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 112
Number of rings: 6

     

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