COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406125
Chemical Name: 2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N,N-diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccccc1)c1ccc2c(c1)OCCCO2)CC

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Molecular Weight: 438.55
Empirical Formula: C23H26N4O3S

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 5.853
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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