COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK147511
Chemical Name: 1-(morpholin-4-yl)-2-{[5-(4-nitrophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: C=CCn1c(SCC(=O)N2CCOCC2)nnc1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 389.44
Empirical Formula: C17H19N5O4S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 3.252
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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