COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK801134
Chemical Name: 4-[(3-fluoro-4-methylphenyl)carbonyl]-3-hydroxy-5-(4-hydroxyphenyl)-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)C1C(=C(C(=O)N1c1nnc(s1)SCc1cccc2c1cccc2)O)C(=O)c1ccc(c(c1)F)C

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Molecular Weight: 583.66
Empirical Formula: C31H22FN3O4S2

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 7.099
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 157
Number of rings: 6

     

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