COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL145828
Chemical Name: 3-(azepan-1-ylmethyl)-6-[2-(4-chlorophenoxy)propan-2-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: CC(c1sc2n(n1)c(nn2)CN1CCCCCC1)(Oc1ccc(cc1)Cl)C

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Molecular Weight: 405.95
Empirical Formula: C19H24ClN5OS

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.335
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 83
Number of rings: 4

     

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