COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852886
Chemical Name: 3-(2-hydroxyphenyl)-4-[4-(methylsulfanyl)phenyl]-5-(tetrahydrofuran-2-ylmethyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: CSc1ccc(cc1)C1N(CC2CCCO2)C(=O)c2c1c([nH]n2)c1ccccc1O

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Saltdata: HCl
Molecular Weight: 421.52
Empirical Formula: C23H23N3O3S

Physical State: Dry powder
Available Amount: 358 mg

Lipinsky:
logP: 1.19
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 103
Number of rings: 5

     

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