COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406161
Chemical Name: 2-{[4-ethyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Smiles: CCn1c(SCC(=O)NCc2cc3OCCCOc3cc2C)nnc1c1ccco1

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Molecular Weight: 428.51
Empirical Formula: C21H24N4O4S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.468
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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