COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245687
Chemical Name: N-({5-[(4-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}methyl)furan-2-carboxamide
Smiles: C=CCn1c(nnc1CNC(=O)c1ccco1)SCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 399.43
Empirical Formula: C18H17N5O4S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 3.089
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 144
Number of rings: 3

     

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