COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK596018
Chemical Name: (4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)C

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Molecular Weight: 525.54
Empirical Formula: C25H23N3O8S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 2.772
Rotatable bonds: 4
H-donors: 1
H-acceptors: 8
PSA: 157
Number of rings: 5

     

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