COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL368313
Chemical Name: {[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nnc(n1c1ccccc1)c1ccc2c(c1)OCCCO2

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Molecular Weight: 383.43
Empirical Formula: C19H17N3O4S

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 5.251
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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