COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL028681
Chemical Name: methyl4-{3a-hydroxy-9-oxo-3,4-bis[(phenylcarbonyl)amino]octahydro-4,7-methanothieno[2,3-d]thiepin-8-yl}butanoate
Smiles: COC(=O)CCCC1C2SCC(C2=O)(C2(C1SCC2NC(=O)c1ccccc1)O)NC(=O)c1ccccc1

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Molecular Weight: 554.69
Empirical Formula: C28H30N2O6S2

Available Amount: 0 mg

Lipinsky:
logP: 4.311
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 172
Number of rings: 5

     

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