COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL006353
Chemical Name: methyl2-({oxo[(2E)-2-(3,4,5-trimethoxybenzylidene)hydrazinyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COc1cc(/C=N/NC(=O)C(=O)Nc2sc3c(c2C(=O)OC)CCCC3)cc(c1OC)OC

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Molecular Weight: 475.52
Empirical Formula: C22H25N3O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.636
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 152
Number of rings: 3

     

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