COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL035558
Chemical Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-4,5,6,7-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(CCN2C(=O)C3=C(C2=O)CCCC3)ccc1OC

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Molecular Weight: 315.37
Empirical Formula: C18H21NO4

Physical State: Dry powder
Available Amount: 4656 mg

Lipinsky:
logP: 3.594
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 55
Number of rings: 3

     

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