COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK273554
Chemical Name: 1-(azepan-1-yl)-3-{[5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}propan-1-one
Smiles: COc1cc(cc(c1OC)OC)c1nnc(o1)SCCC(=O)N1CCCCCC1

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Molecular Weight: 421.52
Empirical Formula: C20H27N3O5S

Physical State: Dry powder
Available Amount: 338 mg

Lipinsky:
logP: 4.568
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 112
Number of rings: 3

     

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