COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063345
Chemical Name: 4-({[(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-{[4-(ethoxycarbonyl)phenyl]imino}-4-oxo-1,3-thiazinan-6-yl]carbonyl}amino)benzoicacid
Smiles: CCOC(=O)c1ccc(cc1)/N=C/1\SC(CC(=O)N1Cc1ccc2c(c1)OCO2)C(=O)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 575.6
Empirical Formula: C29H25N3O8S

Physical State: Dry powder
Available Amount: 413 mg

Lipinsky:
logP: 4.589
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 169
Number of rings: 5

     

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