COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234771
Chemical Name: 3-[(3E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-4,6-dichloro-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: O=C(CC1(O)C(=O)Nc2c1c(Cl)cc(c2)Cl)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 406.22
Empirical Formula: C19H13Cl2NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.589
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 84
Number of rings: 4

     

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