COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333617
Chemical Name: (3Z)-7-nitro-3-[2-oxo-2-(thiophen-2-yl)ethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Smiles: [O-][N+](=O)c1ccc2c(c1)oc(=O)/c(=C/C(=O)c1cccs1)/[nH]2

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Molecular Weight: 316.29
Empirical Formula: C14H8N2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.021
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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