COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL304848
Chemical Name: methyl2-(5-chloro-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoate
Smiles: CSCCC(N1C(=O)C2C(C1=O)CC(=CC2)Cl)C(=O)OC

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Molecular Weight: 331.82
Empirical Formula: C14H18ClNO4S

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 2.784
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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