COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL018906
Chemical Name: ethyl4-{[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-6-(phenylcarbamoyl)-1,3-thiazinan-2-ylidene]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1Cc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1

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Molecular Weight: 531.59
Empirical Formula: C28H25N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.361
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 131
Number of rings: 5

     

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