COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL001938
Chemical Name: ethyl2-{[3-(azepan-1-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCN2CCCCCC2)sc2c1CCCC2

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Molecular Weight: 378.54
Empirical Formula: C20H30N2O3S

Physical State: Dry powder
Available Amount: 2563 mg

Lipinsky:
logP: 5.83
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 86
Number of rings: 3

     

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