COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL231401
Chemical Name: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-(pyridin-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1)c1cccnc1)C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 544.61
Empirical Formula: C27H20N4O5S2

Available Amount: 0 mg

Lipinsky:
logP: 4.567
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 168
Number of rings: 6

     

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