COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK072317
Chemical Name: 2,2'-[5-({4-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}carbamoyl)benzene-1,3-diyl]bis(1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylicacid)
Smiles: O=C(c1cc(cc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O)Nc1ccc(cc1)/C=C/C(=O)c1ccccc1

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Molecular Weight: 705.64
Empirical Formula: C40H23N3O10

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 4.131
Rotatable bonds: 5
H-donors: 3
H-acceptors: 10
PSA: 195
Number of rings: 7

     

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