COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL024302
Chemical Name: ethyl2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC=C2C(=O)CC(CC2=O)(C)C)scc1c1ccccc1

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Molecular Weight: 397.49
Empirical Formula: C22H23NO4S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.01
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 100
Number of rings: 3

     

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