COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406076
Chemical Name: 2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydro-2H-chromen-6-yl)ethanone
Smiles: Cn1c(SCC(=O)c2ccc3c(c2)CCCO3)nnc1c1ccc2c(c1)OCCCO2

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Molecular Weight: 437.52
Empirical Formula: C23H23N3O4S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.738
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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