COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175760
Chemical Name: methyl3-{[4-(azepan-1-ylsulfonyl)phenyl]carbamoyl}-5-nitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCCCC1

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Molecular Weight: 461.5
Empirical Formula: C21H23N3O7S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.078
Rotatable bonds: 3
H-donors: 1
H-acceptors: 7
PSA: 146
Number of rings: 3

     

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