COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK909861
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1OC)C1C(=C(C(=O)N1c1nnc(s1)C)O)C(=O)c1ccc2c(c1)OCCO2

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Molecular Weight: 495.51
Empirical Formula: C24H21N3O7S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.987
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 148
Number of rings: 5

     

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