COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276977
Chemical Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCCCO3)nnc1COc1ccccc1

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Molecular Weight: 452.53
Empirical Formula: C23H24N4O4S

Available Amount: 0 mg

Lipinsky:
logP: 4.558
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 4

     

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