COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK908500
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[3-(3-methylbutoxy)phenyl]-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(CCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O)C

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Molecular Weight: 679.82
Empirical Formula: C37H33N3O6S2

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 9.146
Rotatable bonds: 11
H-donors: 1
H-acceptors: 6
PSA: 164
Number of rings: 7

     

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