COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683382
Chemical Name: 2-[4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(4,4-dimethyl-2,6-dioxocyclohexylidene)butyl]-1H-isoindole-1,3(2H)-dione
Smiles: COc1cc(CCNC(=C2C(=O)CC(CC2=O)(C)C)CCCN2C(=O)c3c(C2=O)cccc3)ccc1OC

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Molecular Weight: 518.61
Empirical Formula: C30H34N2O6

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.502
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 102
Number of rings: 4

     

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