COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK818928
Chemical Name: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-(4-butoxyphenyl)-4-[(3,4-dimethoxyphenyl)carbonyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCOc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc(c(c1)OC)OC)O

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Molecular Weight: 617.75
Empirical Formula: C32H31N3O6S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 7.64
Rotatable bonds: 10
H-donors: 1
H-acceptors: 6
PSA: 164
Number of rings: 5

     

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