COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321534
Chemical Name: (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoicacid
Smiles: OC(=O)CC/C(=C\1/C=C(NC1=O)c1ccc2c(c1)CCCC2)/c1ccc2c(c1)CCCC2

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Molecular Weight: 427.54
Empirical Formula: C28H29NO3

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 7.099
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 5

     

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