COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401164
Chemical Name: (2E)-13-acetyl-2-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-5-methyl-5H,11H-5,11-methano[1,3]thiazolo[2,3-d][1,3,5]benzoxadiazocin-1(2H)-one
Smiles: O=c1/c(=C\c2c(C)nn(c2C)c2ccccc2)/sc2=NC3(C(C(n12)c1ccccc1O3)C(=O)C)C

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Molecular Weight: 484.58
Empirical Formula: C27H24N4O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.224
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 6

     

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