COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK983524
Chemical Name: 6-(azepan-1-ylsulfonyl)-3-[2-(3-nitrophenyl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCCC1

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Molecular Weight: 459.48
Empirical Formula: C21H21N3O7S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 3.63
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 138
Number of rings: 4

     

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