COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK583986
Chemical Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxy-3,5-dimethylphenyl)-4-(3-methoxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: COc1cccc(c1)C1N(CCc2ccc(c(c2)OC)OC)C(=O)c2c1c([nH]n2)c1cc(C)cc(c1O)C

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Molecular Weight: 513.59
Empirical Formula: C30H31N3O5

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.389
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 96
Number of rings: 5

     

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