COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234791
Chemical Name: (3E)-6-chloro-3-[2-(3-methyl-5-phenylthiophen-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: Clc1ccc2c(c1)[nH]/c(=C/C(=O)c1sc(cc1C)c1ccccc1)/c(=O)o2

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Molecular Weight: 395.87
Empirical Formula: C21H14ClNO3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.764
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 4

     

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