COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801133
Chemical Name: 5-(4-butoxyphenyl)-4-[(3-fluoro-4-methylphenyl)carbonyl]-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCOc1ccc(cc1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=C1C(=O)c1ccc(c(c1)F)C)O

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Molecular Weight: 639.77
Empirical Formula: C35H30FN3O4S2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 9.345
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 146
Number of rings: 6

     

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