COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816382
Chemical Name: 4-[(4-butoxyphenyl)carbonyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(c(c1)OC)OC)c1nnc(s1)SCc1ccc(cc1)C

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Molecular Weight: 631.77
Empirical Formula: C33H33N3O6S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 7.85
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 164
Number of rings: 5

     

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