COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK775476
Chemical Name: 2-{4-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-[(3-methoxyphenyl)amino]butyl}-1H-isoindole-1,3(2H)-dione
Smiles: COc1cccc(c1)NC(=C1C(=O)CC(CC1=O)(C)C)CCCN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 460.53
Empirical Formula: C27H28N2O5

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.178
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 92
Number of rings: 4

     

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