COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK117246
Chemical Name: 4-({[(2E)-2-{(2E)-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinylidene}-4-oxo-1,3-thiazinan-6-yl]carbonyl}amino)benzoicacid
Smiles: O=C1N/C(=N\N=C(\CCc2ccc3c(c2)OCO3)/C)/SC(C1)C(=O)Nc1ccc(cc1)C(=O)O

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Molecular Weight: 482.52
Empirical Formula: C23H22N4O6S

Physical State: Dry powder
Available Amount: 433 mg

Lipinsky:
logP: 2.816
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 163
Number of rings: 4

     

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