COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK079660
Chemical Name: N-(4-bromophenyl)-2-[(3-methylbutanoyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxamide
Smiles: CC(CC(=O)Nc1sc2c(c1C(=O)Nc1ccc(cc1)Br)CCCCCCCCCC2)C

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Molecular Weight: 519.55
Empirical Formula: C26H35BrN2O2S

Physical State: Dry powder
Available Amount: 742 mg

Lipinsky:
logP: 10.27
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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