COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079741
Chemical Name: ethyl2-({[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)acetyl]carbamothioyl}amino)-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)CN2C(=O)C3C(C2=O)C2CC3C=C2)sc(c1C)C

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Molecular Weight: 461.56
Empirical Formula: C21H23N3O5S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.159
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 165
Number of rings: 4

     

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