COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK824026
Chemical Name: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[4-(dimethylamino)phenyl]-4-[(3-fluoro-4-methylphenyl)carbonyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1Cl)c1ccc(cc1)N(C)C)C(=O)c1ccc(c(c1)F)C)O

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Molecular Weight: 595.12
Empirical Formula: C29H24ClFN4O3S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 7.309
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 140
Number of rings: 5

     

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