COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK908297
Chemical Name: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 643.74
Empirical Formula: C33H29N3O7S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 7.133
Rotatable bonds: 11
H-donors: 1
H-acceptors: 7
PSA: 173
Number of rings: 6

     

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