COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK419913
Chemical Name: N-(3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-methyl-3-nitrobenzamide
Smiles: CCCC1CCc2c(C1)sc(c2C#N)NC(=O)c1cccc(c1C)[N+](=O)[O-]

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Molecular Weight: 383.47
Empirical Formula: C20H21N3O3S

Physical State: Dry powder
Available Amount: 714 mg

Lipinsky:
logP: 6.155
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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