COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683310
Chemical Name: 2-(4-{2-[(2-hydroxyethyl)amino]-4,4-dimethyl-6-oxocyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Smiles: OCCNC1=C(C(=O)CCCN2C(=O)c3c(C2=O)cccc3)C(=O)CC(C1)(C)C

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Molecular Weight: 398.46
Empirical Formula: C22H26N2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.367
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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