COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816048
Chemical Name: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-[(4-butoxyphenyl)carbonyl]-3-hydroxy-5-(4-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCOc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=C1C(=O)c1ccc(cc1)OCCCC)O

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Molecular Weight: 615.77
Empirical Formula: C33H33N3O5S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 8.631
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 5

     

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