COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL236848
Chemical Name: (3E)-6-chloro-3-(3,3-dimethyl-2-oxobutylidene)-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: Clc1ccc2c(c1)[nH]/c(=C/C(=O)C(C)(C)C)/c(=O)o2

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Molecular Weight: 279.72
Empirical Formula: C14H14ClNO3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.204
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 2

     

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