COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK775464
Chemical Name: 2-(4-{2-[(4-bromophenyl)amino]-4,4-dimethyl-6-oxocyclohex-1-en-1-yl}-4-oxobutyl)-1H-isoindole-1,3(2H)-dione
Smiles: Brc1ccc(cc1)NC1=C(C(=O)CCCN2C(=O)c3c(C2=O)cccc3)C(=O)CC(C1)(C)C

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Molecular Weight: 509.4
Empirical Formula: C26H25BrN2O4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 5.154
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 83
Number of rings: 4

     

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