COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK591716
Chemical Name: 3-(2-hydroxy-3,5-dimethylphenyl)-5-(2-hydroxyethyl)-4-[4-(methylsulfanyl)phenyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: OCCN1C(=O)c2c(C1c1ccc(cc1)SC)c([nH]n2)c1cc(C)cc(c1O)C

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Molecular Weight: 409.51
Empirical Formula: C22H23N3O3S

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 1.477
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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