COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK704391
Chemical Name: 5-(4-tert-butylphenyl)-4-[(3,4-dimethoxyphenyl)carbonyl]-3-hydroxy-1-{5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)c1nnc(s1)SCc1cccc2c1cccc2

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Molecular Weight: 651.81
Empirical Formula: C36H33N3O5S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 9.049
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 6

     

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